WorldWideScience

Sample records for analogue resonance studies

  1. Use of surface plasmon resonance in the binding study of vitamin D, metabolites and analogues with vitamin D binding protein.

    Science.gov (United States)

    Canoa, Pilar; Rivadulla, Marcos L; Popplewell, Jonathan; van Oosten, René; Gómez, Generosa; Fall, Yagamare

    2017-04-01

    Vitamin D3 and its metabolites are lipophilic molecules with low aqueous solubility and must be transported bound to plasma carrier proteins, primarily to vitamin D binding protein (DBP). The biological functions of vitamin D3 metabolites are intimately dependent on the protein, hence the importance of determining their affinity for DBP. In this study, we developed a novel procedure for measuring the kinetic and equilibrium constants of human-DBP with vitamin D3 and three metabolites: 1,25-dihydroxyvitamin D3 [1,25(OH)2D3], 25-hydroxyvitamin D3 (25OHD3) and 24,25-dihydroxyvitamin D3 [24,25(OH)2D3] by surface plasmon resonance (SPR). At the same time, five different analogues, synthetized in our laboratory, were evaluated in order to compare the affinity values with the metabolites. Real-time SPR measurements showed that 25OHD3 and 24,25(OH)2D3 had higher affinity (0.3 μM) than 1,25(OH)2D3 (5 μM), with the higher affinity of 25OHD3 and 24,25(OH)2D3 due to dissociation constants 1 order of magnitude slower. In the case of the analogues, the affinity values were lower, with 1-hydroxy-25-nitro-vitamin D3 (NO2-446), structurally closer to 1,25(OH)2D3, showing the highest value with a K D of 50 μM. (24R)-1,25-dihydroxyvitamin-24-buthyl-28-norvitamin D2 (Bu-471) and (24R)-1,25-dihydroxyvitamin-24-phenyl-28-norvitamin D2 (Ph-491), structurally similar, had affinities of 180 and 170 μM, respectively. (22R,23E)-1-hydroxy-22-ethenyl-25-methoxy-23-dehydrovitamin D3 (MeO-455) and 1-hydroxy-20(R)-[5(S)-(2,2-dimethyltetrahydropyran-5-yl)]-22,23-dinor vitamin D3 (Oxan-429) had affinities of 310 and 100 μM, respectively. The binding of the metabolites and analogues was reversible allowing the rapid capture of data for replicates. The kinetic and equilibrium data for both the metabolites and the analogues fitted to the Langmuir model describing a 1:1 interaction. Graphical Abstract Label-free, real time binding study between vitamin D binding protein immmobilized on the

  2. High Resolution Nuclear Magnetic Resonance Studies of the Active Site of Chymotrypsin. II. Polarization of Histidine 57 by Substrate Analogues and Competitive Inhibitors

    NARCIS (Netherlands)

    Robillard, G.; Shulman, R.G.

    1974-01-01

    The proton nuclear magnetic resonance signal of the His57-Asp102 hydrogen bonded proton in the charge relay system of chymotrypsinogen A and chymotrypsin Aδ has been monitored to determine the influence of substrate analogues and competitive inhibitors on the electronic state of the active site regi

  3. Direct neutron decay of analogue resonances in 105Rh

    Institute of Scientific and Technical Information of China (English)

    Hu Bi-Tao; P.P.Zarubin; U.U.Juravlev

    2006-01-01

    A new method, while takes into account the contribution of direct neutron decay of analogue resonances to the isomeric ratio resulting from (p,n) reaction, is used to analyse the published experimental data for the reaction 104Ru(p,n)104Rh and also estimate a minimum probability of direct decay.

  4. A spectroscopic study of nicotine analogue 2-phenylpyrrolidine (PPD) using resonant two-photon ionization (R2PI), microwave, and 2D NMR techniques.

    Science.gov (United States)

    Martin, Danielle E; Robertson, Evan G; MacLellan, Jonathan G; Godfrey, Peter D; Thompson, Christopher D; Morrison, Richard J S

    2009-02-25

    Conformational preferences of the nicotine analogue 2-phenylpyrrolidine (PPD) have been studied in both gaseous and solution phases. Theoretical calculations at the MP2 and B3LYP levels point to 5-6 stable conformers which differ in three degrees of conformational freedom; torsion between the two rings, inversion at the pyrrolidine (PY) amine, and PY ring puckering, characterized using the Cremer-Pople definition for pseudorotation. Only one conformer has a trans arrangement between the amino hydrogen and the phenyl substituent. It is 6-8 kJ mol(-1) more stable than the cis conformers, has a perpendicular ring arrangement, and puckers at the nitrogen atom--similar to structures reported for nicotine. Resonant two-photon ionization (R2PI) data, including hole burn spectra, indicate only one conformer is present in the free jet expansion, and band contour analysis suggests assignment to the trans conformer. Confirmation was provided by microwave spectroscopy. Fifty-seven lines measured in the 48-72 GHz region were assigned to 206 b-type transitions and fitted to yield rotational constants within 2 MHz of MP2 values predicted for the trans conformer. The solution-phase conformers of PPD were studied using 1D and 2D (1)H NMR spectroscopy and solvent-based theoretical calculations. In marked contrast to the gas phase, NMR data reveals only cis conformers present in solution. Calculations confirm increased stability for these conformers when placed in simulated chloroform or water environments. Solvent molecules are believed to disrupt a crucial N...H(ortho) stabilizing interaction present within the trans conformer.

  5. Space analogue studies in Antarctica

    Science.gov (United States)

    Lugg, D.; Shepanek, M.

    1999-01-01

    Medical research has been carried out on the Australian National Antarctic Research Expeditions (ANARE) for 50 years. As an extension of this program collaborative Australian/United States research on immunology, microbiology, psychology and remote medicine has produced important data and insight on how humans adapt to the stress of extreme isolation, confinement and the harsh environment of Antarctica. An outstanding analogue for the isolation and confinement of space missions (especially planetary outposts), ANARE has been used as an international research platform by Australia and the United States since 1993. Collaborative research has demonstrated a lowered responsiveness of the immune system under the isolation and confinement of Antarctic winter-over; a reduction of almost 50% in T cell proliferation to mitogen phytohaemogglutinin, as well as changes in latent herpesvirus states and the expansion of the polyclonal latent Epstein-Barr virus infected B cell populations. Although no clinically significant disease has been found to result from these immune changes, research is currently assessing the effects of psychological factors on the immune system. This and associated research performed to date and its relevance to both organisations is discussed, and comment made on possible extensions to the program in both medical and other fields.

  6. Spectroscopic study of solar twins and analogues

    CERN Document Server

    Datson, Juliet; Portinari, Laura

    2014-01-01

    Context. Many large stellar surveys have been and are still being carried out, providing huge amounts of data, for which stellar physical parameters will be derived. Solar twins and analogues provide a means to test the calibration of these stellar catalogues because the Sun is the best-studied star and provides precise fundamental parameters. Solar twins should be centred on the solar values. Aims. This spectroscopic study of solar analogues selected from the Geneva-Copenhagen Survey (GCS) at a resolution of 48,000 provides effective temperatures and metallicities for these stars. We test whether our spectroscopic parameters, as well as the previous photometric calibrations, are properly centred on the Sun. In addition, we search for more solar twins in our sample. Methods. The methods used in this work are based on literature methods for solar twin searches and on methods we developed in previous work to distinguish the metallicity-temperature degeneracies in the differential comparison of spectra of solar ...

  7. On the resonances of a rotating black hole analogue

    CERN Document Server

    Dolan, Sam R; Crispino, Luís C B

    2011-01-01

    Under certain conditions, sound waves in a fluid may be governed by a Klein-Gordon equation on an `effective spacetime' determined by the background flow properties. Here we study the `draining bathtub' (DBT) system, a circulating, draining flow whose effective spacetime has key features in common with the rotating black hole (Kerr) spacetime. We investigate the spectrum of quasinormal (QN) mode and Regge pole resonances exhibited by the DBT, and we compare with the equivalent Kerr spectra. First, to demonstrate the ubiquity of `QN ringing', we simulate the evolution of a perturbation in the time domain by applying a finite-difference method. Next, we solve the wave equation in the frequency domain, using the continued-fraction method to compute QN frequencies. We explore the geometric link between null geodesic orbits and QN frequencies, and apply an asymptotic method to provide an expansion of QN frequencies in inverse powers of mode number $m$. The same range of methods is then applied to study the (closel...

  8. MAQARIN natural analogue study: phase III

    Energy Technology Data Exchange (ETDEWEB)

    Alexander, W.R.; Mazurek, M.; Waber, H.N. [Univ. of Berne (Switzerland). Institutes of Geology, Mineralogy and Petrology, Rock-Water Interaction Group (GGWW); Arlinger, J.; Erlandson, A.C.; Hallbeck, L.; Pedersen, K. [Goeteborg Univ. (Sweden). Dept. of General and Marine Microbiology; Boehlmann, W.; Fritz, P.; Geyer, S.; Geyer, W.; Hanschman, G.; Kopinke, F.D.; Poerschmann, J. [Umweltforschungszentrum Leipzig-Halle (Germany); Chambers, A.V.; Haworth, A.; Ilett, D.; Linklater, C.M.; Tweed, C.J. [AEA Technology plc, Harwell (United Kingdom); Chenery, S.R.N.; Kemp, S.J.; Milodowski, A.E.; Pearce, J.M.; Reeder, S.; Rochelle, C.A.; Smith, B.; Wetton, P.D.; Wragg, J. [British Geological Survey, Keyworth (United Kingdom); Clark, I.D. [Univ. of Ottawa (Canada). Dept. of Geology; Hodginson, E.; Hughes, C.R. [Univ. of Manchester (United Kingdom). Dept. of Earth Sciences; Hyslop, E.K. [British Geological Survey, Edinburgh (United Kingdom); Karlsson, F. [Swedish Nuclear Fuel and Waste Management Co., Stockholm (Sweden); Khoury, H.N.; Salameh, E. [Univ. of Jordan, Amman (Jordan); Lagerblad, B. [Cement Inst., Stockholm (Sweden); Longworth, G. [Univ. of Manchester (United Kingdom). Dept. of Geology; Pitty, A.F. [Private consultant, Norwich (United Kingdom); Savage, D. [QuantiSci Ltd, Melton Mowbray (United Kingdom); Smellie, J.A.T. [ed.] [Conterra AB, Uppsala (Sweden)

    1998-12-01

    This report represents the conclusion to Phase III of the Maqarin Natural Analogue Study. The main thrust was to establish the origin and chemistry of the Western Springs hyper alkaline groundwaters (Na/K enriched Ca(OH){sub 2} type) and to study their interaction with rocks of different compositions, as natural analogues to key processes that might occur at an early stage within the `alkali disturbed zone` of cementitious repositories in different host rocks. Whilst earlier studies at Maqarin were very much site-specific and process-oriented, Phase III provided a regional perspective to the geological evolution of the Maqarin region. This was made possible by greater field access which allowed a more systematic structural and geomorphological study of the area. This has resulted in a greater understanding of the age and spatial relationships concerning formation of the cement zones through spontaneous combustion of the Bituminous Marls, and the subsequent formation of high pH groundwaters at the Eastern and Western Springs locations. At the Western Springs locality, hydrochemical and hydrogeological evaluation of new and published data (plus access to unpublished data), together with detailed mineralogical and geochemical studies, helped to clarify the very earliest stage of cement leachate/host rock interaction. The data were used also to test coupled flow/transport codes developed to assess the long-term evolution of a cementitious repository. Additional objectives addressed include: a) rock matrix diffusion, b) the occurrence and chemical controls on zeolite composition, e) the occurrence and chemical controls on clay stability, and d) the role of microbes, organics and colloids in trace element transport. The Maqarin site now provides a consistent picture explaining the origin of the hyperalkaline groundwaters, and is therefore a unique location for the examination of the mechanisms and processes associated with cementitious repositories. Application of these

  9. MAQARIN natural analogue study: phase III

    Energy Technology Data Exchange (ETDEWEB)

    Alexander, W.R.; Mazurek, M.; Waber, H.N. [Univ. of Berne (Switzerland). Institutes of Geology, Mineralogy and Petrology, Rock-Water Interaction Group (GGWW); Arlinger, J.; Erlandson, A.C.; Hallbeck, L.; Pedersen, K. [Goeteborg University (Sweden). Dept. of General and Marine Microbiology; Boehlmann, W.; Fritz, P.; Geyer, S.; Geyer, W.; Hanschman, G.; Kopinke, F.D.; Poerschmann, J. [Umweltforschungszentrum Leipzig-Halle (Germany); Chambers, A.V.; Haworth, A.; Ilett, D.; Linklater, C.M.; Tweed, C.J. [AEA Technology plc, Harwell (United Kingdom); Chenery, S.R.N.; Kemp, S.J.; Milodowski, A.E.; Pearce, J.M.; Reeder, S.; Rochelle, C.A.; Smith, B.; Wetton, P.D.; Wragg, J. [British Geological Survey, Keyworth (United Kingdom); Clark, I.D. [Univ. of Ottawa (Canada). Dept. of Geology; Hodginson, E.; Hughes, C.R. [Univ. of Manchester (United Kingdom). Dept. of Earth Sciences; Hyslop, E.K. [British Geological Survey, Edinburgh (United Kingdom); Karlsson, F. [Swedish Nuclear Fuel and Waste Management Co., Stockholm (Sweden); Khoury, H.N.; Salameh, E. [Univ. of Jordan, Amman (Jordan); Lagerblad, B. [Cement Institute, Stockholm (Sweden); Longworth, G. [Univ. of Manchester (United Kingdom). Dept. of Geology; Pitty, A.F. [Private consultant, Norwich (United Kingdom); Savage, D. [QuantiSci Ltd, Melton Mowbray (United Kingdom); Smellie, J.A.T. [ed.] [Conterra AB, Uppsala (Sweden)

    1998-12-01

    This report represents the conclusion to Phase III of the Maqarin Natural Analogue Study. The main thrust was to establish the origin and chemistry of the Western Springs hyper alkaline groundwaters (Na/K enriched Ca(OH){sub 2} type) and to study their interaction with rocks of different compositions, as natural analogues to key processes that might occur at an early stage within the `alkali disturbed zone` of cementitious repositories in different host rocks. Whilst earlier studies at Maqarin were very much site-specific and process-oriented, Phase III provided a regional perspective to the geological evolution of the Maqarin region. This was made possible by greater field access which allowed a more systematic structural and geomorphological study of the area. This has resulted in a greater understanding of the age and spatial relationships concerning formation of the cement zones through spontaneous combustion of the Bituminous Marls, and the subsequent formation of high pH groundwaters at the Eastern and Western Springs locations. At the Western Springs locality, hydrochemical and hydrogeological evaluation of new and published data (plus access to unpublished data), together with detailed mineralogical and geochemical studies, helped to clarify the very earliest stage of cement leachate/host rock interaction. The data were used also to test coupled flow/transport codes developed to assess the long-term evolution of a cementitious repository. Additional objectives addressed include: a) rock matrix diffusion, b) the occurrence and chemical controls on zeolite composition, e) the occurrence and chemical controls on clay stability, and d) the role of microbes, organics and colloids in trace element transport. The Maqarin site now provides a consistent picture explaining the origin of the hyperalkaline groundwaters, and is therefore a unique location for the examination of the mechanisms and processes associated with cementitious repositories. Application of these

  10. The relevance of analogue studies for understanding obsessions and compulsions.

    Science.gov (United States)

    Abramowitz, Jonathan S; Fabricant, Laura E; Taylor, Steven; Deacon, Brett J; McKay, Dean; Storch, Eric A

    2014-04-01

    Analogue samples are often used to study obsessive-compulsive (OC) symptoms and related phenomena. This approach is based on the hypothesis that results derived from such samples are relevant to understanding OC symptoms in individuals with a diagnosis of obsessive-compulsive disorder (OCD). Two decades ago, Gibbs (1996) reviewed the available literature and found initial support for this hypothesis. Since then there have been many important advances addressing this issue. The purpose of the present review was to synthesize various lines of research examining the assumptions of using analogue samples to draw inferences about people with OCD. We reviewed research on the prevalence of OC symptoms in non-clinical populations, the dimensional (vs. categorical) nature of these symptoms, phenomenology, etiology, and studies on developmental and maintenance factors in clinical and analogue samples. We also considered the relevance of analogue samples in OCD treatment research. The available evidence suggests research with analogue samples is highly relevant for understanding OC symptoms. Guidelines for the appropriate use of analogue designs and samples are suggested.

  11. A linear endothelin-1 analogue: solution structure of ET-1[Aib1,3,11,15, Nle7] by nuclear magnetic resonance spectroscopy and molecular modelling.

    Science.gov (United States)

    Hewage, C M; Jiang, L; Parkinson, J A; Ramage, R; Sadler, I H

    1999-07-01

    Two-dimensional nuclear magnetic resonance techniques and a combination of distance geometry and molecular dynamics calculations were utilised to determine the three dimensional solution structure of an ET-1 analogue, ET-1[Aib1,3,11,15, Nle7], in a methanol-d3/water co-solvent. The modelled structure shows that the peptide folds into a consistent alpha-helical conformation between residues Ser4-His16 while the C-terminus prefers no fixed conformation. Our studies confirm that the disulphide links which are normally associated with the endothelin family of neuropeptides are not important for the formation of a helical conformation in solution. This full length, modified, synthetic linear ET-1 analogue plays a vital role towards designing endothelin receptor agonists. Structure activity relationships are discussed in terms of the conformational features of the calculated structure.

  12. 3D-QSAR Studies of Dimethoxyphenoxyphenoxy pyrimidines and Analogues

    Institute of Scientific and Technical Information of China (English)

    李爱秀; 王瑾玲; 苏华庆; 缪方明

    2000-01-01

    Three-dimensional quantitative structure-activity relationships (3DQSAR) of a series of dimethoxyphenoxyphenoxypyrimidines and analogues which are known to be photosystem Ⅱ (PS Ⅱ )inhibitors have been studied using comparative molecular field analysis (CoMFA) method. The results suggest that the steric and electronic properties of substitutes at m-position on the end phenyl ring have important influence on the Hill reaction inhibition.

  13. Conformational equilibrium of phenylacetic acid and its halogenated analogues through theoretical studies, NMR and IR spectroscopy

    Science.gov (United States)

    Levandowski, Mariana N.; Rozada, Thiago C.; Melo, Ulisses Z.; Basso, Ernani A.; Fiorin, Barbara C.

    2017-03-01

    This paper presents a study on the conformational preferences of phenylacetic acid (PA) and its halogenated analogues (FPA, CPA, BPA). To clarify the effects that rule these molecules' behaviour, theoretical calculations were used, for both the isolated phase and solution, combined with nuclear magnetic resonance (NMR) and infrared (IR) spectroscopy. Most conformations of phenylacetic acid and its halogenated derivatives are stabilized through the hyperconjugative effect, which rules the conformational preference. NMR analyses showed that even with the variation in medium polarity, there was no significant change in the conformation population. Infrared spectroscopy showed similar results for all compounds under study. In most spectra, two bands were found through the carbonyl deconvolution, which is in accordance with the theoretical data. It was possible to prove that variation in the nature of the substituent in the ortho position had no significant influence on the conformational equilibrium.

  14. Natural analogue studies for the safety case development of radioactive waste disposal in Korea

    Energy Technology Data Exchange (ETDEWEB)

    Choi, Kyung-Woo [Korea Institute of Nuclear Safety, 305-338 Daejeon (Korea, Republic of); Baik, Min-Hoon [Korea Atomic Energy Research Institute, 305-353 Daejeon (Korea, Republic of)

    2014-07-01

    The natural analogue study is an analogy approach to investigate natural occurrences of materials, conditions and processes that are similar to those known or predicted to occur in some part of a radioactive waste disposal system. Countries considering the disposal of radioactive waste have been working on their domestic natural analogue studies for developing the safety case and improving the disposal safety. Natural analogue study can effectively be applied to the understanding of a long-term behavior of the post-closure repository, the provision of quantitative data required for the safety assessment models, and the supplementary safety indicator to prove the safety of deep geological disposal. Therefore the natural analogue studies play an important role in the safety case which requires a multiple lines of evidence including the safety assessment for the geological disposal of radioactive wastes. In this study, current status of foreign natural analogue studies was investigated by summarizing their results related with repository materials, radionuclide migration and retardation. Main results, issues, and their applicability of the foreign natural analogue studies were also analyzed. The results of natural analogue studies in Korea were categorized and summarized according to the studies on the uranium ore bodies, rocks, groundwater, and archeological artifacts. Although so many studies on the natural analogue have been carried out during last several decades in Korea, their results have not been actively applied to the safety assessment and safety case development for radioactive waste disposal. Therefore, applicable methods of natural analogues were summarized and a methodology for improving their applicability was examined. Additionally, in order to improve the application of these results from natural analogue studies, build-up of a natural analogue information database was in progress and its status will be presented. (authors)

  15. Conformational studies of immunodominant myelin basic protein 1-11 analogues using NMR and molecular modeling.

    Science.gov (United States)

    Laimou, Despina; Lazoura, Eliada; Troganis, Anastassios N; Matsoukas, Minos-Timotheos; Deraos, Spyros N; Katsara, Maria; Matsoukas, John; Apostolopoulos, Vasso; Tselios, Theodore V

    2011-11-01

    Τwo dimensional nuclear magnetic resonance studies complimented by molecular dynamics simulations were conducted to investigate the conformation of the immunodominant epitope of acetylated myelin basic protein residues 1-11 (Ac-MBP(1-11)) and its altered peptide ligands, mutated at position 4 to an alanine (Ac-MBP(1-11)[4A]) or a tyrosine residue (Ac-MBP(1-11)[4Y]). Conformational analysis of the three analogues indicated that they adopt an extended conformation in DMSO solution as no long distance NOE connectivities were observed and seem to have a similar conformation when bound to the active site of the major histocompatibility complex (MHC II). The interaction of each peptide with MHC class II I-A(u) was further investigated in order to explore the molecular mechanism of experimental autoimmune encephalomyelitis induction/inhibition in mice. The present findings indicate that the Gln(3) residue, which serves as a T-cell receptor (TCR) contact site in the TCR/peptide/I-A(u) complex, has a different orientation in the mutated analogues especially in the Ac-MBP(1-11)[4A] peptide. In particular the side chain of Gln(3) is not solvent exposed as for the native Ac-MBP(1-11) and it is not available for interaction with the TCR.

  16. Phase characteristics of electromagnetically induced transparency analogue in coupled resonant systems

    CERN Document Server

    Zhou, Xiaoyan; Pang, Wei; Zhang, Hao; Yang, Qingrui; Zhang, Daihua

    2013-01-01

    Electromagnetically induced transparency (EIT) and EIT-like effects have been investigated in a wide variety of coupled resonant systems. Here, a classification of the phase characteristics of the EIT-like spectral responses is presented. Newly identified phase responses reveal unexplored operation regimes of EIT-like systems. Taking advantage of the new phase regimes, one can obtain group delay, dispersion and nonlinearity properties greatly enhanced by almost one order of magnitude, compared to the traditionally constructed EIT-like devices, which breaks the fundamental limitation (e.g., delay-bandwidth product) intrinsic to atomic EIT and EIT-like effects. Optical devices and electrical circuits are analyzed as examples showing the universality of our finding. We show that cavity-QED-based quantum phase gates can be greatly improved to achieve a phase shift of {\\pi}. The new phase characteristics are also believed to be useful to build novel doubly resonant devices in quantum information based on cavity QE...

  17. Structure, Stability and Interaction Studies on Nucleotide Analogue Systems

    Directory of Open Access Journals (Sweden)

    R. Kanakaraju

    2003-08-01

    Full Text Available Abstract: Most of the biological molecules have a good interaction with water molecules. The hydrogen bonding interactions with the structural analogues of nucleic acid phosphate group namely dimethyl phosphate anion (DMP and diethyl phosphate anion (DEP are studied employing the ab initio and density functional theory methods. Inspections have been made to locate the reactive sites for the interactions of isomeric forms of mono, di and tri hydrates of alkyl phosphate anion using the above theories. It reveals, water molecules have a very strong interaction with the phosphate group in both the molecules and their interactions induce the changes in the structural parameters of the PO4 group for both the DMP and DEP anions. The optimized structural parameters, total energy, dipole moment and rotational constants are calculated and are compared with the available experimental values. The chemical hardness and chemical potential for these complexes have been calculated at HF/6-31G* level of theory and discussed the conformational stability of these complexes.

  18. Acoustic analogue of electronic BLOCH oscillations and resonant Zener tunneling in ultrasonic superlattices.

    Science.gov (United States)

    Sanchis-Alepuz, Helios; Kosevich, Yuriy A; Sánchez-Dehesa, José

    2007-03-30

    We demonstrate the existence of Bloch oscillations of acoustic fields in sound propagation through a superlattice of water cavities and layers of methyl methacrylate. To obtain the acoustic equivalent of a Wannier-Stark ladder, we employ a set of cavities with different thicknesses. Bloch oscillations are observed as time-resolved oscillations of transmission in a direct analogy to electronic Bloch oscillations in biased semiconductor superlattices. Moreover, for a particular gradient of cavity thicknesses, an overlap of two acoustic minibands occurs, which results in resonant Zener-like transmission enhancement.

  19. Emotions and Habitability study in Moon Mars Analogue.

    Science.gov (United States)

    Mertens, Alexandre; Lia Schlacht, Irene

    Euro Moon Mars mission have been conducted by students and field researchers in the Mars Desert Research Station (MDRS) a habitat installed by the Mars Society (MS) in the Utah desert. The campaign was supported by ILEWG International Lunar Exploration Working Group, ESTEC, NASA Ames, and partners. It investigated human aspects of isolation in a Mars analogue base. The project is in line with the ILEWG which coordinates several MDRS missions, and contributes to the preparation of future Mars sample return missions. The objective is to study and improve the habitat dynamics in a closed and small environment. Investigation cover different fields as emotional, sociological and psychological aspects and a food study but also habitability aspects. The study has been conducted by asking to the crew members to perform task and fill in questionnaires before, during and after the simulation. Video recovering, pictures and heart rate counting will also be used. One of the main study subject, conducted by Bernard Rimé, concerns the sharing of emotions in an isolated environ-e ment. Another is "Mars Habitability Experiment", which responsible is Irene Schlacht, will try to determine whether humans need variability of stimuli such as it happens in the natural environment -e.g. seasonal changing -to gain efficiency, reliability and well-being. This study have been conducted from February 19 to April 19 on two crews presenting different aspects that could lead to various behaviours. The first crew is made of people from different countries that don't know each other very well. On the opposite, the second crew members have the same cultural background -they come from the same country, university -and they know each other for at least six months. This allow studying how the extreme conditions of the isolation affect the crew efficiency, creativity and sanity according to its homogeneity. Report on the science and technical results, and implications for Earth-Mars comparative stud-ies

  20. Natural analogue studies as supplements to biomineralization research

    Energy Technology Data Exchange (ETDEWEB)

    McNeil, M.B. [Nuclear Regulatory Commission, Washington, DC (United States)

    1995-09-01

    Chemical reactions can alter the chemistry and crystal structure of solid objects over archeological or geological times, while preserving external physical shapes. The reactions resulting in these structures offer natural analogues to laboratory experiments in biomineralization and to biologically influenced alteration of nuclear waste packages, and thus, they offer the only available way of validating models that purport waste package behavior over archaeological or geological times. Potential uses of such analogues in the construction and validation of hypothetical mechanisms of microbiological corrosion and biomineralization are reviewed. Evidence from such analogues suggests that biofilms can control materials alteration in ways usually overlooked. The newly hypothesized mechanisms involve control by biofilms of the cation flow near the solid surface and offer plausible mechanisms for the formation of mixed-cation minerals under conditions that would lead to dealloying in abiotic experiments; they also account for the formation of unusual minerals [such as posnjakite, Cu{sub 4}SO{sub 4}(OH){sub 6{center_dot}}H{sub 2}O] and mineral morphologies unusual in corrosion [malachite, Cu{sub 2}CO{sub 3}(OH){sub 2}, rarely forms botryoidally under corrosion conditions and its occasional presence on archaeological objects that appear to have undergone microbiological corrosion may be related to biofilm phenomena].

  1. A photoactive isoprenoid diphosphate analogue containing a stable phosphonate linkage: synthesis and biochemical studies with prenyltransferases

    Science.gov (United States)

    DeGraw, Amanda J.; Zhao, Zongbao; Strickland, Corey L.; Taban, A. Huma; Hsieh, John; Michael, Jefferies; Xie, Wenshuang; Shintani, David; McMahan, Colleen; Cornish, Katrina; Distefano, Mark D.

    2008-01-01

    A number of biochemical processes rely on isoprenoids, including the post-translational modification of signaling proteins and the biosynthesis of a wide array of compounds. Photoactivatable analogues have been developed to study isoprenoid utilizing enzymes such as the isoprenoid synthases and prenyltransferases. While these initial analogues proved to be excellent structural analogues with good cross linking capability, they lack the stability needed when the goals include isolation of cross-linked species, tryptic digestion, and subsequent peptide sequencing. Here, the synthesis of a benzophenone-based farnesyl diphosphate analogue containing a stable phosphonophosphate group is described. Inhibition kinetics, photolabeling experiments, as well as x-ray crystallographic analysis with a protein prenyltransferase are described, verifying this compound as a good isoprenoid mimetic. In addition, the utility of this new analogue was explored by using it to photoaffinity label crude protein extracts obtained from Hevea brasiliensis latex. Those experiments suggest that a small protein, Rubber Elongation Factor, interacts directly with farnesyl diphosphate during rubber biosynthesis. These results indicate that this benzophenone-based isoprenoid analogue will be useful for identifying enzymes that utilize farnesyl diphosphate as a substrate. PMID:17477573

  2. Experimental and Theoretical Studies of the Structures and Interactions of Vancomycin Antibiotics with Cell Wall Analogues

    Energy Technology Data Exchange (ETDEWEB)

    Yang, Zhibo; Vorpagel, Erich R.; Laskin, Julia

    2008-10-01

    Surface-induced dissociation (SID) of the singly protonated complex of vancomycin antibiotic with cell wall peptide analogue (Nα,Nε-diacetyl-L-Lys-D-Ala-D-Ala) was studied using a 6 T Fourier Transform Ion Cyclotron Resonance Mass Spectrometer (FT-ICR MS) specially configured for SID experiments. The binding energy between the vancomycin and the peptide was obtained from the RRKM modeling of the time- and energy resolved fragmentation efficiency curves (TFECs) of the precursor ion and its fragments. Electronic structure calculations of the geometries, proton affinities and binding energies were performed for several model systems including vancomycin (V), vancomycin aglycon (VA), Nα,Nε-diacetyl-L-Lys-D-Ala-D-Ala, and non-covalent complexes of VA with N-acetyl-D-Ala-D-Ala and Nα,Nε-diacetyl-L-Lys-D-Ala-D-Ala at the B3LYP/6-31G(d) level of theory. Comparison between the experimental and computational results suggests that the most probable structure of the complex observed in our experiments corresponds to the neutral peptide bound to the vancomycin protonated at the secondary amino group of the N-methyl-leucine residue. The experimental binding energy of 30.9 ± 1.8 kcal/mol is in good agreement with the binding energy of 29.3 ± 2.5 kcal/mol calculated for the model system representing the preferred structure of the complex.

  3. Structure-activity study of pentamidine analogues as antiprotozoal agents.

    Science.gov (United States)

    Bakunova, Svetlana M; Bakunov, Stanislav A; Patrick, Donald A; Kumar, E V K Suresh; Ohemeng, Kwasi A; Bridges, Arlene S; Wenzler, Tanja; Barszcz, Todd; Jones, Susan Kilgore; Werbovetz, Karl A; Brun, Reto; Tidwell, Richard R

    2009-04-09

    Diamidine 1 (pentamidine) and 65 analogues (2-66) have been tested for in vitro antiprotozoal activities against Trypanosoma brucei rhodesiense, Plasmodium falciparum, and Leishmania donovani, and for cytotoxicity against mammalian cells. Dications 32, 64, and 66 exhibited antitrypanosomal potencies equal or greater than melarsoprol (IC(50) = 4 nM). Nine congeners (2-4, 12, 27, 30, and 64-66) were more active against P. falciparum than artemisinin (IC(50) = 6 nM). Eight compounds (12, 32, 33, 44, 59, 62, 64, and 66) exhibited equal or better antileishmanial activities than 1 (IC(50) = 1.8 microM). Several congeners were more active than 1 in vivo, curing at least 2/4 infected animals in the acute mouse model of trypanosomiasis. The diimidazoline 66 was the most promising compound in the series, showing excellent in vitro activities and high selectivities against T. b. rhodesiense, P. falciparum, and L. donovani combined with high antitrypanosomal efficacy in vivo.

  4. A Study of Secondary Ion Triple Bond Analogues.

    Science.gov (United States)

    1980-08-20

    into the formation of cluster ions have measured secondary energy spectra (35-42] and the effects of surface adsorbed gases on secondary yields [43,44...GeCI’ Cl:Ge 0.13 GaTe Te:GaP 0.1 SnAs a Sn:GaAs 0.08 SiBr+ Br:Si < 0.02 Sicl+ CI:Si < 0.01 SiSb- Sb:Si c GeAs As :Ge d Gap Ge: GaP e InSe - Se:InPh f... GaSe Se:GaAs f GeBr Br:Ge f GeSb Sb :Ge f SiAS Si: GaAs 9 a Not a triple bond analogue b ’to Ge detected, (signal < "cps) c Large SiSb- signal, implant

  5. QSAR Studies of 6-Amino Uracil Base Analogues: A Thymidine Phosphorylase Inhibitor in Cancer Therapy

    Directory of Open Access Journals (Sweden)

    Surya Prakash B. N. Gupta

    2008-01-01

    Full Text Available A novel series of 6-amino uracil base analogue were synthesized. QSAR study was used to relate the selective nonsubstrate inhibitory activity of 6-amino uracil base analogue with various physicochemical descriptors. Stepwise multiple regression analysis was performed to find out the correlation between various physicochemical descriptors and biological activity of the compounds by using Openstat 2 version 6.5.1 and valstat statistical software. Out of the several equations developed, the best equation having the highest significance was selected for further study. The equation is able to explain 60% of total variance and are more than 95% significant as revealed by the F value.

  6. Study of Mode Coupling on Coaxial Resonators

    Institute of Scientific and Technical Information of China (English)

    Rui Liu; Hong-Fu Li

    2011-01-01

    A study of mode coupling phenomenon of coaxial resonators has been conducted with theories.Through establishing the source-free transmission line equation,boundary conditions of the coaxial resonators with a corrugated inner conductor are analyzed.In the end,calculations are performed in a wide range of corrugation parameters for the resonator of the Karisruhe Institute of Technology (KIT) relevant coaxial gyrotron.

  7. The interaction of new piroxicam analogues with lipid bilayers--a calorimetric and fluorescence spectroscopic study.

    Science.gov (United States)

    Maniewska, Jadwiga; Szczęśniak-Sięga, Berenika; Poła, Andrzej; Sroda-Pomianek, Kamila; Malinka, Wiesław; Michalak, Krystyna

    2014-01-01

    The purpose of the present paper was to assess the ability of new piroxicam analogues to interact with the lipid bilayers. The results of calorimetric and fluorescence spectroscopic experiments of two new synthesized analogues of piroxicam, named PR17 and PR18 on the phase behavior of phospholipid bilayers and fluorescence quenching of fluorescent probes (Laurdan and Prodan), which molecular location within membranes is known with certainty, are shown in present work. The presented results revealed that, depending on the details of chemical structure, the studied compounds penetrated the lipid bilayers.

  8. Organometallic nucleoside analogues with ferrocenyl linker groups: synthesis and cancer cell line studies.

    Science.gov (United States)

    Nguyen, Huy V; Sallustrau, Antoine; Balzarini, Jan; Bedford, Matthew R; Eden, John C; Georgousi, Niki; Hodges, Nikolas J; Kedge, Jonathan; Mehellou, Youcef; Tselepis, Chris; Tucker, James H R

    2014-07-10

    Examples of organometallic compounds as nucleoside analogues are rare within the field of medicinal bioorganometallic chemistry. We report on the synthesis and properties of two chiral ferrocene derivatives containing a nucleobase and a hydroxyalkyl group. These so-called ferronucleosides show promising anticancer activity, with cytostatic studies on five different cancer cell lines indicating that both functional groups are required for optimal activity.

  9. An experimental analogue study into the role of abstract thinking in trauma-related rumination

    NARCIS (Netherlands)

    Ehring, T.; Szeimies, A.-K.; Schaffrick, C.

    2009-01-01

    Trauma-related rumination has been shown to predict the maintenance of posttraumatic stress disorder (PTSD). However, it is still unclear how rumination can be distinguished from functional forms of thinking about traumatic events. The current study used an analogue design to experimentally test the

  10. Alpha resonant scattering for astrophysical reaction studies

    Energy Technology Data Exchange (ETDEWEB)

    Yamaguchi, H.; Kahl, D.; Nakao, T. [Center for Nuclear Study (CNS), University of Tokyo, RIKEN campus, 2-1 Hirosawa, Wako, Saitama 351-0198 (Japan); Wakabayashi, Y.; Kubano, S. [The Institute of Physical and Chemical Research (RIKEN), 2-1 Hirosawa, Wako, Saitama 351-0198 (Japan); Hashimoto, T. [Research Center for Nuclear Physics (RCNP), Osaka University, 10-1 Mihogaoka, Ibaraki, Osaka 567-0047 (Japan); Hayakawa, S. [Istituto Nazionale Fisica Nucleare - Laboratori Nazionali del Sud (INFN-LNS), Via S. Sofia 62, 95125 Catania (Italy); Kawabata, T. [Department of Physics, Kyoto University, Kita-Shirakawa, Kyoto 606-8502 (Japan); Iwasa, N. [Department of Physics, Tohoku University, Aoba, Sendai, Miyagi 980-8578 (Japan); Teranishi, T. [Department of Physics, Kyushu University, 6-10-1 Hakozaki, Fukuoka 812-8581 (Japan); Kwon, Y. K. [Institute for Basic Science, 70, Yuseong-daero 1689-gil, Yuseong-gu, Daejeon 305-811 (Korea, Republic of); Binh, D. N. [30 MeV Cyclotron Center, Tran Hung Dao Hospital, Hoan Kiem District, Hanoi (Viet Nam); Khiem, L. H.; Duy, N. G. [Institute of Physics, Vietnam Academy of Science and Technology, 18 Hong Quoc Viet, Nghia do, Hanoi (Viet Nam)

    2014-05-02

    Several alpha-induced astrophysical reactions have been studied at CRIB (CNS Radioactive Ion Beam separator), which is a low-energy RI beam separator at Center for Nuclear Study (CNS) of the University of Tokyo. One of the methods to study them is the α resonant scattering using the thick-target method in inverse kinematics. Among the recent studies at CRIB, the measurement of {sup 7}Be+α resonant scattering is discussed. Based on the result of the experiment, we evaluated the contributions of high-lying resonances for the {sup 7}Be(α,γ) reaction, and proposed a new cluster band in {sup 11}C.

  11. Endo-S-c-di-GMP Analogues-Polymorphism and Binding Studies with Class I Riboswitch

    Directory of Open Access Journals (Sweden)

    Herman O. Sintim

    2012-11-01

    Full Text Available C-di-GMP, a cyclic guanine dinucleotide, has been shown to regulate biofilm formation as well as virulence gene expression in a variety of bacteria. Analogues of c-di-GMP have the potential to be used as chemical probes to study c-di-GMP signaling and could even become drug leads for the development of anti-biofilm compounds. Herein we report the synthesis and biophysical studies of a series of c-di-GMP analogues, which have both phosphate and sugar moieties simultaneously modified (called endo-S-c-di-GMP analogues. We used computational methods to predict the relative orientation of the guanine nucleobases in c-di-GMP and analogues. DOSY NMR of the endo-S-c-di-GMP series showed that the polymorphism of c-di-GMP can be tuned with conservative modifications to the phosphate and sugar moieties (conformational steering. Binding studies with Vc2 RNA (a class I c-di-GMP riboswitch revealed that conservative modifications to the phosphate and 2'-positions of c-di-GMP dramatically affected binding to class I riboswitch.

  12. Conformational preferences of proline derivatives incorporated into vasopressin analogues: NMR and molecular modelling studies.

    Science.gov (United States)

    Sikorska, Emilia; Sobolewski, Dariusz; Kwiatkowska, Anna

    2012-04-01

    In this study, arginine vasopressin analogues modified with proline derivatives - indoline-2-carboxylic acid (Ica), (2S,4R)-4-(naphthalene-2-ylmethyl)pyrrolidine-2-carboxylic acid (Nmp), (2S,4S)-4-aminopyroglutamic acid (APy) and (2R,4S)-4-aminopyroglutamic acid, (Apy) - were examined using NMR spectroscopy and molecular modelling methods. The results have shown that Ica is involved in the formation of the cis peptide bond. Moreover, it reduces to a great extent the conformational flexibility of the peptide. In turn, incorporation of (2S,4R)-Nmp stabilizes the backbone conformation, which is heavily influenced by the pyrrolidine ring. However, the aromatic part of the Nmp side chain exhibits a high degree of conformational freedom. With analogues IV and V, introduction of the 4-aminopyroglumatic acid reduces locally conformational space of the peptides, but it also results in weaker interactions with the dodecylphosphocholine/sodium dodecyl sulphate micelle. Admittedly, both analogues are adsorbed on the micelle's surface but they do not penetrate into its core. With analogue V, the interactions between the peptide and the micelle seem to be so weak that conformational equilibrium is established between different bound states.

  13. THEORETICAL STUDY OF PODOPHYLLOTOXIN AND QUINOLONE ANALOGUES AS ANTITUMOR DRUGS

    Institute of Scientific and Technical Information of China (English)

    何峰; 戴颖仪; 朱孝峰; 黄爱东; 张翎; 颜少平; 刘宗潮

    2002-01-01

    Objective: To study the active sites of podophyllotoxin derivatives. Methods: Some podophyllotoxin derivatives were analyzed by quantum and mechanics method. Results: Some information was given according to the calculation results about HOMO and LUMO electron density. The C-4 position is the position for effective modification. The B ring and E ring are important active centers. Conclusion: The hole of positive charge in B ring easily combines with an acceptor within the molecular. Some quinolones with similar electronic construction to podophyllotoxin may have antitumor activity.

  14. Synthetic studies of neoclerodane diterpenes from Salvia divinorum: preparation and opioid receptor activity of salvinicin analogues.

    Science.gov (United States)

    Simpson, Denise S; Katavic, Peter L; Lozama, Anthony; Harding, Wayne W; Parrish, Damon; Deschamps, Jeffrey R; Dersch, Christina M; Partilla, John S; Rothman, Richard B; Navarro, Hernan; Prisinzano, Thomas E

    2007-07-26

    Further modification of salvinorin A (1a), the major active component of Salvia divinorum, has resulted in the synthesis of novel neoclerodane diterpenes with opioid receptor affinity and activity. We report in this study that oxadiazole 11a and salvidivin A (12a), a photooxygenation product of 1a, have been identified as the first neoclerodane diterpenes with kappa antagonist activity. This indicates that additional structural modifications of 1a may lead to analogues with higher potency and utility as drug abuse medications.

  15. Numerical study of higher order analogues of the Tracy-Widom distribution

    CERN Document Server

    Claeys, Tom

    2011-01-01

    We study a family of distributions that arise in critical unitary random matrix ensembles. They are expressed as Fredholm determinants and describe the limiting distribution of the largest eigenvalue when the dimension of the random matrices tends to infinity. The family contains the Tracy-Widom distribution and higher order analogues of it. We compute the distributions numerically by solving a Riemann-Hilbert problem numerically, plot the distributions, and discuss several properties that they appear to exhibit.

  16. cis-Nitenpyram Analogues Containing 1,4-Dihydropyridine: Synthesis, Insecticidal Activities, and Molecular Docking Studies

    Institute of Scientific and Technical Information of China (English)

    孙传文; 陈艳霞; 刘天雁; 吴颖; 方庭; 王静; 邢家华

    2012-01-01

    A novel series of cb-nitenpyram analogues (2a--2p) were designed and prepared by introducing the 1,4-dihydropyridine, with their eis-configuration confirmed by X-ray diffraction. Preliminary bioassays showed that most compounds exhibited good insecticidal activities at 20 mg/L against Aphis medicagini, and analogues 2a and 2d aflbrded the best activity, and both of them had 100% mortality at 4 mg/L. In addition, molecular docking studies were also performed to model the ligand-receptor complexes, and the results explained the structure-activity relationships observed in vitro, which may provide some useful information for future design of new insecticides.

  17. Understanding Rubredoxin Redox Sites by Density Functional Theory Studies of Analogues

    Energy Technology Data Exchange (ETDEWEB)

    Luo, Yan; Niu, Shuqiang; Ichiye, Toshiko

    2012-09-06

    Determining the redox energetics of redox site analogues of metalloproteins is essential in unraveling the various contributions to electron transfer properties of these proteins. Since studies of the [4Fe-4S] analogues show that the energies are dependent on the ligand dihedral angles, broken symmetry density functional theory (BS-DFT) with the B3LYP functional and double-ζ basis sets calculations of optimized geometries and electron detachment energies of [1Fe] rubredoxin analogues are compared to crystal structures and gas-phase photoelectron spectroscopy data, respectively, for [Fe(SCH3)4]0/1-/2-, [Fe(S2-o-xyl)2]0/1-/2-, and Na+[Fe(S2-oxyl) 2]1-/2- in different conformations. In particular, the study of Na+[Fe(S2-o-xyl)2]1-/2- is the only direct comparison of calculated and experimental gas phase detachment energies for the 1-/2- couple found in the rubredoxins. These results show that variations in the inner sphere energetics by up to ~0.4 eV can be caused by differences in the ligand dihedral angles in either or both redox states. Moreover, these results indicate that the protein stabilizes the conformation that favors reduction. In addition, the free energies and reorganization energies of oxidation and reduction as well as electrostatic potential charges are calculated, which can be used as estimates in continuum electrostatic calculations of electron transfer properties of [1Fe] proteins.

  18. Electrodynamic study of YIG filters and resonators

    Science.gov (United States)

    Krupka, Jerzy; Salski, Bartlomiej; Kopyt, Pawel; Gwarek, Wojciech

    2016-01-01

    Numerical solutions of coupled Maxwell and Landau-Lifshitz-Gilbert equations for a magnetized yttrium iron garnet (YIG) sphere acting as a one-stage filter are presented. The filter is analysed using finite-difference time-domain technique. Contrary to the state of the art, the study shows that the maximum electromagnetic power transmission through the YIG filter occurs at the frequency of the magnetic plasmon resonance with the effective permeability of the gyromagnetic medium μr ≈ −2, and not at a ferromagnetic resonance frequency. Such a new understanding of the YIG filter operation, makes it one of the most commonly used single-negative plasmonic metamaterials. The frequency of maximum transmission is also found to weakly depend on the size of the YIG sphere. An analytic electromagnetic analysis of resonances in a YIG sphere is performed for circularly polarized electromagnetic fields. The YIG sphere is situated in a free space and in a large spherical cavity. The study demonstrates that both volume resonances and magnetic plasmon resonances can be solutions of the same transcendental equations. PMID:27698467

  19. Nonlinear resonances

    CERN Document Server

    Rajasekar, Shanmuganathan

    2016-01-01

    This introductory text presents the basic aspects and most important features of various types of resonances and anti-resonances in dynamical systems. In particular, for each resonance, it covers the theoretical concepts, illustrates them with case studies, and reviews the available information on mechanisms, characterization, numerical simulations, experimental realizations, possible quantum analogues, applications and significant advances made over the years. Resonances are one of the most fundamental phenomena exhibited by nonlinear systems and refer to specific realizations of maximum response of a system due to the ability of that system to store and transfer energy received from an external forcing source. Resonances are of particular importance in physical, engineering and biological systems - they can prove to be advantageous in many applications, while leading to instability and even disasters in others. The book is self-contained, providing the details of mathematical derivations and techniques invo...

  20. Synthesis of reactive nucleic acid analogues and their application for the study of structure and functions of biopolymers

    Energy Technology Data Exchange (ETDEWEB)

    Kanevskii, Igor' E; Kuznetsova, Svetlana A [Department of Chemistry, M.V. Lomonosov Moscow State University, Moscow (Russian Federation)

    1998-07-31

    Data on the synthesis of reactive derivatives of nucleic acid analogues and their application for the study of structure and functions of biopolymers are generalised. The main types of such analogues including photoactivated reagents containing azidoaryl, halogeno, and thiol groups, psoralen and its derivatives, platinum-based reagents, and nucleic acid analogues containing substituted pyrophosphate or acyl phosphate internucleotide groups are presented. The mechanisms of interaction of these compounds with proteins and nucleic acids are considered. The prospects for the in vivo application of reactive nucleic acids in various systems are discussed. The bibliography includes 76 references.

  1. The effect of the pairing interaction on the energies of isobar analogue resonances in {sup 112-124}Sb and isospin admixture in {sup 100-124}Sn isotopes

    Energy Technology Data Exchange (ETDEWEB)

    Babacan, Tahsin [Department of Physics, Celal Bayar University, Manisa (Turkey); Salamov, Djavad [Department of Physics, Anadolu University, Eskisehir (Turkey); Kuecuekbursa, Atalay [Department of Physics, Dumlupinar University, Kuetahya (Turkey); Babacan, Halil [Department of Physics, Celal Bayar University, Manisa (Turkey); Maras, Ismail [Department of Physics, Celal Bayar University, Manisa (Turkey); Aygoer, Hasan A [Department of Physics, Celal Bayar University, Manisa (Turkey); Uenal, Arslan [Department of Physics, Dumlupinar University, Kuetahya (Turkey)

    2004-06-01

    In the present study, the effect of the pairing interaction and the isovector correlation between nucleons on the properties of the isobar analogue resonances (IAR) in {sup 112-124}Sb isotopes and the isospin admixture in {sup 100-124}Sn isotopes is investigated within the framework of the proton-neutron quasi-particle random phase approximation (pnQRPA). The form of the interaction strength parameter is related to the shell-model potential by restoring the isotopic invariance of the nuclear part of the total Hamiltonian. In this respect, the isospin admixtures in the {sup 100-124}Sn isotopes are calculated, and the dependence of the differential cross section and the volume integral J{sub F} for the Sn({sup 3}He,t)Sb reactions at E({sup 3}He) =200 MeV occurring by the excitation of IAR on mass number A is examined. Our results show that the calculated value for the isospin mixing in the {sup 100}Sn isotope is in good agreement with Colo et al's estimates (4-5%), and the obtained values for the volume integral change within the error range of the value reported by Fujiwara et al (53 {+-} 5 MeV fm{sup 3}). Moreover, it is concluded that although the differential cross section of the isobar analogue resonance for the ({sup 3}He,t) reactions is not sensitive to pairing correlations between nucleons, a considerable effect on the isospin admixtures in N {approx} Z isotopes can be seen with the presence of these correlations.

  2. A Resonant Damping Study Using Piezoelectric Materials

    Science.gov (United States)

    Min, J. B.; Duffy, K. P.; Choi, B. B.; Morrison, C. R.; Jansen, R. H.; Provenza, A. J.

    2008-01-01

    Excessive vibration of turbomachinery blades causes high cycle fatigue (HCF) problems requiring damping treatments to mitigate vibration levels. Based on the technical challenges and requirements learned from previous turbomachinery blade research, a feasibility study of resonant damping control using shunted piezoelectric patches with passive and active control techniques has been conducted on cantilever beam specimens. Test results for the passive damping circuit show that the optimum resistive shunt circuit reduces the third bending resonant vibration by almost 50%, and the optimum inductive circuit reduces the vibration by 90%. In a separate test, active control reduced vibration by approximately 98%.

  3. Study on resonance frequency of thermoacoustic resonance pipes

    Institute of Scientific and Technical Information of China (English)

    FAN Li; WANG Benren; JIN Tao; ZHANG Shuyi

    2005-01-01

    For calculating the resonance frequency of practical resonance pipes more precisely, two methods are presented, which are the method of acoustic pressure simulation and the method of minimum point of standing wave. Both methods are based on the theoretical simulation of the acoustic pressure distribution in the pipe and the relation between the minimum point position of the standing wave and the acoustic impedances of the pipe terminations.It is demonstrated that both methods can calculate the resonance frequency of a pipe more precisely by considering the effect of the acoustic resistances of both terminations of the pipe.Therefore both methods presented are more useful in acoustic research fields in which the resonance frequency of a pipe must be controlled strictly. In addition, both methods can get the same calculation results despite of their different ways. The method of the minimum point of standing wave is more convenient, nevertheless the method of acoustic pressure simulation can derive the resonance frequency and the distribution of the acoustic pressure in the pipe simultaneously.

  4. Synthesis of analogues of (-)-cytisine for in vivo studies of nicotinic receptors using positron emission tomography.

    Science.gov (United States)

    Marrière, E; Rouden, J; Tadino, V; Lasne, M C

    2000-04-20

    [formula: see text] 9-Substituted analogues of (-)-cytisine were synthesized in high yields via palladium-mediated couplings of either 9-(-)-bromocytisine and organostannanes or 9-(-)-trimethylstannylcytisine and fluorobromobenzene. The protection of the amine with a nitroso group and the use of PdCl2(PPh3)2 to carry out the Stille reaction allowed the rapid synthesis of 9-(4'-[18F]fluorophenyl)cytisine (18F: t1/2 = 109.7 min), a new promising radioligand (radiochemical yield: 10% from [18F]KF, 150 min, four steps) for positron emission tomography studies of alpha 4 beta 2 nicotinic receptors.

  5. Characterization and comparison of perezone with some analogues. Experimental and theoretical study

    Science.gov (United States)

    Escobedo-González, Rene Gerardo; Bahena, Luis; Arias Tellez, José Luis; Hinojosa Torres, Jaime; Ruvalcaba, Rene Miranda; Aceves-Hernández, Juan Manuel

    2015-10-01

    Perezone had been used for centuries in the traditional Mexican medicine, it is useful and a handful of illness. Perezone and other derivatives also present activity against certain lines of cancer, such as the myeloblastoid leukemia cell line K-562 and carcinoma cell lines (PC-3 and SKLU-1) with IC50 important in the biological activity of these natural products. The docking score energetic values are in good agreement with the experimental cytotoxic results obtained from the experiments when perezone and analogues were studied in different types of cancer.

  6. Numerical and experimental studies of resonators with reduced resonant frequencies and small electrical sizes

    CERN Document Server

    Hao, T; Edwards, D J; Stevens, C J

    2008-01-01

    Methods on reducing resonant frequencies and electrical sizes of resonators are reported in this paper. Theoreti-cal and numerical analysis has been used and the results for the broadside-coupled resonators from both studies exhibit good agreement. Initial fabrication techniques are proposed and measurement results are compared with simulations. Further high resolution techniques have been envisaged to enhance the performance of the resona-tors. This class of small resonators with low resonant frequencies indicates a variety of applications in the design of microwave devices.

  7. In vitro and in vivo biocompatibility studies of a recombinant analogue of spidroin 1 scaffolds.

    Science.gov (United States)

    Moisenovich, M M; Pustovalova, O L; Arhipova, A Yu; Vasiljeva, T V; Sokolova, O S; Bogush, V G; Debabov, V G; Sevastianov, V I; Kirpichnikov, M P; Agapov, I I

    2011-01-01

    The goal of this study was to generate porous scaffolds from the genetically engineered protein, an analogue of Nephila clavipes spidroin 1 (rS1/9) and to assess the properties of new rS1/9 scaffolds essential for bioengineering. The salt leaching technique was used to make the rS1/9 scaffolds of interconnected macroporous structure with spontaneously formed micropores. The tensile strength of scaffolds was 18 ± 5 N/cm(2). Scaffolds were relatively stable in a phosphate buffer but degraded in oxidizing environment after 11 weeks of incubation. Applicability of the recombinant spidroin 1 as a substrate for cell culture was demonstrated by successful 3T3 cells growth on the surface of rS1/9 films (270 ± 20 cells/mm(2) vs. 97 ± 8 cells/mm(2) on the glass surface, p 0.05), whereas the initial distribution was 58% ± 7% and 11% ± 8%, respectively; p < 0.05). The rS1/9 scaffolds implanted subcutaneously into Balb/c mice were well tolerated. Over a 2-month period, the scaffolds promoted an ingrowth of de novo formed vascularized connective tissue elements and nerve fibers. Thus, scaffolds made of the novel recombinant spidroin 1 analogue are potentially applicable in tissue engineering.

  8. NASA/ESMD Analogue Mission Plans

    Science.gov (United States)

    Hoffman, Stephen J.

    2007-01-01

    A viewgraph presentation exploring Earth and its analogues is shown. The topics include: 1) ESMD Goals for the Use of Earth Analogues; 2) Stakeholders Summary; 3) Issues with Current Analogue Situation; 4) Current state of Analogues; 5) External Implementation Plan (Second Step); 6) Recent Progress in Utilizing Analogues; 7) Website Layout Example-Home Page; 8) Website Layout Example-Analogue Site; 9) Website Layout Example-Analogue Mission; 10) Objectives of ARDIG Analog Initiatives; 11) Future Plans; 12) Example: Cold-Trap Sample Return; 13) Example: Site Characterization Matrix; 14) Integrated Analogue Studies-Prerequisites for Human Exploration; and 15) Rating Scale Definitions.

  9. Membrane metamaterial resonators with a sharp resonance: A comprehensive study towards practical terahertz filters and sensors

    Directory of Open Access Journals (Sweden)

    Yongyao Chen

    2012-06-01

    Full Text Available We investigate the resonant properties of high quality-factor membrane-based metamaterial resonators functioning in the terahertz regime. A number of factors, including the resonator geometry, dielectric loss, and most importantly the membrane thickness are found to extensively influence the resonance strength and quality factor of the sharp resonance. Further studies on the membrane thickness-dependent-sensitivity for sensing applications reveal that high quality-factor membrane metamaterials with a moderate thickness ranging from 10 to 50 μm are the most promising option towards developing realistic integrated terahertz filters and sensors.

  10. A study of tumour growth based on stoichiometric principles: a continuous model and its discrete analogue.

    Science.gov (United States)

    Saleem, M; Agrawal, Tanuja; Anees, Afzal

    2014-01-01

    In this paper, we consider a continuous mathematically tractable model and its discrete analogue for the tumour growth. The model formulation is based on stoichiometric principles considering tumour-immune cell interactions in potassium (K (+))-limited environment. Our both continuous and discrete models illustrate 'cancer immunoediting' as a dynamic process having all three phases namely elimination, equilibrium and escape. The stoichiometric principles introduced into the model allow us to study its dynamics with the variation in the total potassium in the surrounding of the tumour region. It is found that an increase in the total potassium may help the patient fight the disease for a longer period of time. This result seems to be in line with the protective role of the potassium against the risk of pancreatic cancer as has been reported by Bravi et al. [Dietary intake of selected micronutrients and risk of pancreatic cancer: An Italian case-control study, Ann. Oncol. 22 (2011), pp. 202-206].

  11. A phase II study of the vitamin D analogue Seocalcitol in patients with inoperable hepatocellular carcinoma

    DEFF Research Database (Denmark)

    Dalhoff, K; Dancey, J; Astrup, L

    2003-01-01

    Hepatocellular carcinoma (HCC) is a common malignant tumour, which has a poor prognosis. Surgical resection can be curative but most patients are inoperable and most chemotherapy agents have minimal activity in this disease. Seocalcitol, a vitamin D analogue, induces differentiation and inhibits...... growth in cancer cell lines and in vivo. The vitamin D receptor is expressed in hepatocytes and more abundantly in HCC cells. In total, 56 patients with inoperable advanced HCC were included in an uncontrolled study of oral Seocalcitol treatment for up to 1 year (with possible extension for responders...... for 29 and at least 36 months (patient still in remission when data censored). Seocalcitol was well tolerated; the most frequent toxicity was hypercalcaemia and related symptoms. Most patients tolerated a daily dose of 10 micro g of Seocalcitol. This is the first study showing activity, by reduction...

  12. Nuclear Quadrupole Resonance Study of Potassium - - Chloride.

    Science.gov (United States)

    Ramia, Maximo Elias

    Fast Fourier transform nuclear quadrupole resonance (NQR) was used to study the cubic antifluorite crystal potassium hexacloro-osmate, K(,2)OsCl(,6). The study of the ('35)Cl and ('37)Cl resonances were performed on three samples of K(,2)OsCl(,6), a powder sample, a powder sample recrystallized from D(,2)O and a single crystal sample. The studies were carried out in the temperature range 300 to 6K. A detailed study of the ('35)Cl and ('37)Cl NQR lineshapes, in the temperature range 70 to 300K, showed that the lineshapes reflect the strain fields produced by lattice dislocations and point defects. The temperature evolution of these strain fields give rise to a satellite line which previously was attributed to H('+) ion impurities present in the samples. A comprehensive study of the temperature evolution of the NQR spectrum in the vicinity of the phase transition revealed a drop of line intensity and the progressive appearance of an extra broad resonance component. Both effects are associated with the existence of precursor dynamic clusters at temperatures higher than T(,C). Qualitatively similar but quantitatively different behaviour was observed in the powder and single crystal samples. Although the precursor clusters are an intrinsic property of the phrase transition, their detailed dynamics is sample independent. A NQR study of the tetragonal phase showed that at the lowest temperature the ratio of line intensities is 2:1. The phase shift effect previously observed in the tetragonal phase of K(,2)ReCl(,6) was also observed in K(,2)OsCl(,6). The effect has been explained as an experimental artifact introduced by the truncation of the FID due to the spectrometer dead time. Spin-lattice relaxation measurements in the cubic phase show two component relaxation in the vicinity of T(,C). The behaviour is quantitatively different in the powder and single crystal samples. The short relaxation time is associated with dynamic clusters. Spin-lattice relaxation time

  13. Study on resonance frequency distribution of high-overtone bulk acoustic resonators

    Institute of Scientific and Technical Information of China (English)

    ZHANG Hui; WANG Zuoqing; ZHANG Shuyi

    2005-01-01

    Based on the method of characterizing piezo-films by the resonance frequency distributions, the factors influencing the resonance frequency distribution of a High-overtone Bulk Acoustic Resonator (HBAR) consisting of a piezoelectric thin film with twoelectrodes and a substrate are studied. Some HBARs are simulated. The results manifest that changing the acoustic impedance ratio of the substrate to piezo-film the distribution of the space of the parallel resonance frequency and the effective electromechanical coupling factor are changed. When the fundamental mode of the piezo-film is at high frequency, changing the acoustic impedance ratio of the electrode to piezo-film and the thickness of the electrodes make the resonance frequency distribution of HBARs change. These results manifest that the HBARs can be resonant at specified frequencies by means of adjusting the factors affecting the resonance frequency distribution.

  14. Magnetic resonance spectroscopy studies in migraine

    Energy Technology Data Exchange (ETDEWEB)

    Montagna, P.; Cortelli, P.; Barbiroli, B. (Inst. of Medical Pathology, Univ. of Bologna (Italy))

    1994-06-01

    The authors describe the method of [sup 31]phosphorus magnetic resonance spectroscopy and review the results when it is applied to the study of brain and muscle energy metabolism in migraine subjects. Brain energy metabolism appears to be abnormal in all major subtypes of migraine when measured both during and between attacks. Impaired energy metabolism is also documented in skeletal muscle. It is suggested that migraine is associated with a generalized disorder of mitochondrial oxidative phosphorylation and that this may constitute a threshold for the triggering of migraine attacks. 47 refs., 10 figs., 3 tabs.

  15. Watson-Crick Base Pairing, Electronic and Photophysical Properties of Triazole Modified Adenine Analogues: A Computational Study

    KAUST Repository

    Das, Shubhajit

    2015-09-17

    We employ first-principles Density Functional Theory (DFT) and time-dependent DFT (TDDFT) to elucidate structural, electronic and optical properties of a few recently reported triazole adenine nucleobase analogues. The results are compared against the findings obtained for both natural adenine nucleobase and available experimental data. The optical absorption of these adenine analogues are calculated both in gas-phase and in solvent (methanol) using Polarized Continuum Model (PCM). We find that all the analogues show a red-shifted absorption profile as compared to adenine. Our simulated emission spectra in solvent compare fairly well with experimentally observed results. We investigate base paring ability of these adenine analogues with thymine. The calculations on the intrinsic stability of these base pairs ascertain that all the adenine analogues form the hydrogen bonded Watson-Crick base pair with similar H-bonding energy as obtained for natural adenine-thymine base pair. In our study, we provide a microscopic origin of the low-energy absorption and emission peaks, observed experimentally.

  16. Study of resonance in wind parks

    OpenAIRE

    Monjo, Lluis; Sainz, Luis; Liang, Jun; Pedra, Joaquín

    2015-01-01

    Wind turbine harmonic current emissions are a well-known power quality problem. These emissions flow through wind park impedances, leading to grid voltage distortion. Parallel resonance may worsen the problem because it increases voltage distortion around the resonance frequency. Hence, it is interesting to analyze the parallel resonance phenomenon. The paper explores this phenomenon in wind parks and provides analytical expressions to determine parallel resonances. (C) 2015 The Authors. Publ...

  17. Novel enterobactin analogues as potential therapeutic chelating agents: Synthesis, thermodynamic and antioxidant studies

    Science.gov (United States)

    Zhang, Qingchun; Jin, Bo; Shi, Zhaotao; Wang, Xiaofang; Liu, Qiangqiang; Lei, Shan; Peng, Rufang

    2016-09-01

    A series of novel hexadentate enterobactin analogues, which contain three catechol chelating moieties attached to different molecular scaffolds with flexible alkyl chain lengths, were prepared. The solution thermodynamic stabilities of the complexes with uranyl, ferric(III), and zinc(II) ions were then investigated. The hexadentate ligands demonstrate effective binding ability to uranyl ion, and the average uranyl affinities are two orders of magnitude higher than 2,3-dihydroxy-N1,N4-bis[(1,2-hydroxypyridinone-6-carboxamide)ethyl]terephthalamide [TMA(2Li-1,2-HOPO)2] ligand with similar denticity. The high affinity of hexadentate ligands could be due to the presence of the flexible scaffold, which favors the geometric agreement between the ligand and the uranyl coordination preference. The hexadentate ligands also exhibit higher antiradical efficiency than butylated hydroxyanisole (BHA). These results provide a basis for further studies on the potential applications of hexadentate ligands as therapeutic chelating agents.

  18. Study of the performance of ATLAS prototype detectors using analogue LHC front-end electronics

    CERN Document Server

    Riedler, P; Kaplon, J; Weilhammer, Peter

    2002-01-01

    The silicon strip detectors in the ATLAS experiment at LHC will be exposed to very high hadron fluences. In order to study the radiation damage effects ATLAS prototype detectors and small test detectors were irradiated to a fluence of 3 * 10/sup 14/ 24 GeV protons/cm/sup 2/. After irradiation, the detectors were annealed at 25 degrees C to simulate the damage foreseen after 10 years of ATLAS operation. The detectors were then connected to the SCT32A analogue front-end chips and tested with a /sup 106/Ru source. The performance of the irradiated detectors was compared to non-irradiated detectors from the same batch. The charge collection efficiency is discussed taking into account the electronic response of the readout chip and the ballistic deficit. (10 refs).

  19. Advancing Translational Space Research Through Biospecimen Sharing: Amplified Impact of Studies Utilizing Analogue Space Platforms

    Science.gov (United States)

    Staten, B.; Moyer, E.; Vizir, V.; Gompf, H.; Hoban-Higgins, T.; Lewis, L.; Ronca, A.; Fuller, C. A.

    2016-01-01

    Biospecimen Sharing Programs (BSPs) have been organized by NASA Ames Research Center since the 1960s with the goal of maximizing utilization and scientific return from rare, complex and costly spaceflight experiments. BSPs involve acquiring otherwise unused biological specimens from primary space research experiments for distribution to secondary experiments. Here we describe a collaboration leveraging Ames expertise in biospecimen sharing to magnify the scientific impact of research informing astronaut health funded by the NASA Human Research Program (HRP) Human Health Countermeasures (HHC) Element. The concept expands biospecimen sharing to one-off ground-based studies utilizing analogue space platforms (e.g., Hindlimb Unloading (HLU), Artificial Gravity) for rodent experiments, thereby significantly broadening the range of research opportunities with translational relevance for protecting human health in space and on Earth.

  20. Stochastic resonance and chaotic resonance in bimodal maps: A case study

    Indian Academy of Sciences (India)

    G Ambika; N V Sujatha; K P Harikrishnan

    2002-09-01

    We present the results of an extensive numerical study on the phenomenon of stochastic resonance in a bimodal cubic map. Both Gaussian random noise as well as deterministic chaos are used as input to drive the system between the basins. Our main result is that when two identical systems capable of stochastic resonance are coupled, the SNR of either system is enhanced at an optimum coupling strength. Our results may be relevant for the study of stochastic resonance in biological systems.

  1. Reactivity descriptors and electron density analysis for ligand chemistry: A case study of 2,2'-bipyridine and its analogues

    Indian Academy of Sciences (India)

    Bhakti S Kulkarni; Akhilesh Tanwar; Sourav Pal

    2007-09-01

    In this paper, we study the reactivity of diimines like 2,2'-bipyridine and its analogues using reactivity descriptors. We discuss evaluation of local descriptors using relaxed as well as frozen approximation and characterize the / acceptance/donor characteristics of the above ligands. The intermolecular reactivity sequence for the same systems is examined by the global and local philicity index. In addition, electron density analysis has been carried out to highlight the possible strengths of interaction of the bipyridine and its analogues with metal ions.

  2. Antifungal activity of eugenol analogues. Influence of different substituents and studies on mechanism of action.

    Science.gov (United States)

    Carrasco, Héctor; Raimondi, Marcela; Svetaz, Laura; Di Liberto, Melina; Rodriguez, María V; Espinoza, Luis; Madrid, Alejandro; Zacchino, Susana

    2012-01-19

    Twenty one phenylpropanoids (including eugenol and safrole) and synthetic analogues, thirteen of them new compounds, were evaluated for antifungal properties, first with non-targeted assays against a panel of human opportunistic pathogenic fungi. Some structure-activity relationships could be observed, mainly related to the influence of an allyl substituent at C-4, an OH group at C-1 and an OCH(3) at C-2 or the presence of one or two NO(2) groups in different positions of the benzene ring. All active compounds were tested in a second panel of clinical isolates of C. albicans and non-albicans Candida spp., Cryptococcus neoformans and dermatophytes. The eugenol derivative 4-allyl-2-methoxy-5-nitrophenol (2) was the most active structure against all strains tested, and therefore it was submitted to targeted assays. These studies showed that the antifungal activity of 2 was not reversed in the presence of an osmotic support such as sorbitol, suggesting that it does not act by inhibiting the fungal cell wall synthesis or assembly. On the other hand, the Ergosterol Assay showed that 2 did not bind to the main sterol of the fungal membrane up to 250 µg mL-1. In contrast, a 22% of fungal membrane damage was observed at concentrations = 1 × MIC and 71% at 4× MIC, when 2 was tested in the Cellular Leakage assay. The comparison of log P and MICs for all compounds revealed that the antifungal activity of the eugenol analogues would not to be related to lipophilicity.

  3. Antifungal Activity of Eugenol Analogues. Influence of Different Substituents and Studies on Mechanism of Action

    Directory of Open Access Journals (Sweden)

    Melina Di Liberto

    2012-01-01

    Full Text Available Twenty one phenylpropanoids (including eugenol and safrole and synthetic analogues, thirteen of them new compounds, were evaluated for antifungal properties, first with non-targeted assays against a panel of human opportunistic pathogenic fungi. Some structure-activity relationships could be observed, mainly related to the influence of an allyl substituent at C-4, an OH group at C-1 and an OCH3 at C-2 or the presence of one or two NO2 groups in different positions of the benzene ring. All active compounds were tested in a second panel of clinical isolates of C. albicans and non-albicans Candida spp., Cryptococcus neoformans and dermatophytes. The eugenol derivative 4-allyl-2-methoxy-5-nitrophenol (2 was the most active structure against all strains tested, and therefore it was submitted to targeted assays. These studies showed that the antifungal activity of 2 was not reversed in the presence of an osmotic support such as sorbitol, suggesting that it does not act by inhibiting the fungal cell wall synthesis or assembly. On the other hand, the Ergosterol Assay showed that 2 did not bind to the main sterol of the fungal membrane up to 250 µg mL−1. In contrast, a 22% of fungal membrane damage was observed at concentrations = 1 × MIC and 71% at 4× MIC, when 2 was tested in the Cellular Leakage assay. The comparison of log P and MICs for all compounds revealed that the antifungal activity of the eugenol analogues would not to be related to lipophilicity.

  4. Bicyclic proline analogues as organocatalysts for stereoselective aldol reactions: an in silico DFT study.

    Science.gov (United States)

    Shinisha, C B; Sunoj, Raghavan B

    2007-04-21

    Density functional theory has been employed in investigating the efficiency of a series of bicyclic analogues of proline as stereoselective organocatalysts for the aldol reaction. Three classes of conformationally restricted proline analogues, as part of either a [2.2.1] or [2.1.1] bicyclic framework, have been studied. Transition states for the stereoselective C-C bond formation between enamines derived from [2.2.1] and [2.1.1] bicyclic amino acids and p-nitrobenzaldehyde, leading to enantiomeric products, have been identified. Analysis of the transition state geometries revealed that the structural rigidity of catalysts, improved transition state organization as well as other weak interactions influence the relative stabilities of diastereomeric transition states and help contribute to the overall stereoselectivity in the aldol reaction. These bicyclic catalysts are predicted to be substantially more effective in improving the enantiomeric excess than the widely used organocatalyst proline. Enantiomeric excesses in the range 82-95% are predicted for these bicyclic catalysts when a sterically unbiased substrate such as p-nitrobenzaldehyde is employed for the asymmetric aldol reaction. More interestingly, introduction of substituents, as simple as a methyl group, at the ortho position of the aryl aldehyde bring about an increase in the enantiomeric excess to values greater than 98%. The reasons behind the vital energy separation between diastereomeric transition states has been rationalized with the help of a number of weak interactions such as intramolecular hydrogen bonding and Coulombic interactions operating on the transition states. These predictions could have wider implications for the rational design of improved organocatalysts for stereoselective carbon-carbon bond-forming reactions.

  5. Molecular modeling of methyl-α-Neu5Ac analogues docked against cholera toxin--a molecular dynamics study.

    Science.gov (United States)

    Blessy, J Jino; Sharmila, D Jeya Sundara

    2015-02-01

    Molecular modeling of synthetic methyl-α-Neu5Ac analogues modified in C-9 position was investigated by molecular docking and molecular dynamics (MD) simulation methods. Methyl-α-Neu5Ac analogues were docked against cholera toxin (CT) B subunit protein and MD simulations were carried out for three Methyl-α-Neu5Ac analogue-CT complexes (30, 10 and 10 ns) to estimate the binding activity of cholera toxin-Methyl-α-Neu5Ac analogues using OPLS_2005 force field. In this study, direct and water mediated hydrogen bonds play a vital role that exist between the methyl-α-9-N-benzoyl-amino-9-deoxy-Neu5Ac (BENZ)-cholera toxin active site residues. The Energy plot, RMSD and RMSF explain that the simulation was stable throughout the simulation run. Transition of phi, psi and omega angle for the complex was calculated. Molecular docking studies could be able to identify the binding mode of methyl-α-Neu5Ac analogues in the binding site of cholera toxin B subunit protein. MD simulation for Methyl-α-9-N-benzoyl-amino-9-deoxy-Neu5Ac (BENZ), Methyl-α-9-N-acetyl-9-deoxy-9-amino-Neu5Ac and Methyl-α-9-N-biphenyl-4-acetyl-deoxy-amino-Neu5Ac complex with CT B subunit protein was carried out, which explains the stable nature of interaction. These methyl-α-Neu5Ac analogues that have computationally acceptable pharmacological properties may be used as novel candidates for drug design for cholera disease.

  6. [Gastric magnetic resonance study (methods, semiotics)].

    Science.gov (United States)

    Stashuk, G A

    2003-01-01

    The paper shows the potentialities of gastric study by magnetic resonance imaging (MRI). The methodic aspects of gastric study have been worked out. The MRI-semiotics of the unchanged and tumor-affected wall of the stomach and techniques in examining patients with gastric cancer of various sites are described. Using the developed procedure, MRI was performed in 199 patients, including 154 patients with gastric pathology and 45 control individuals who had no altered gastric wall. Great emphasis is placed on the role of MRI in the diagnosis of endophytic (diffuse) gastric cancer that is of priority value in its morphological structure. MRI was found to play a role in the diagnosis of the spread of a tumorous process both along the walls of the stomach and to its adjacent anatomic structures.

  7. Design, Synthesis, EPR-Studies and Conformational Bias of Novel Spin-Labeled DCC-Analogues for the Highly Regioselective Labeling of Aliphatic and Aromatic Carboxylic Acids.

    Science.gov (United States)

    Gölz, Jan Philipp; NejatyJahromy, Yaser; Bauer, Mirko; Muhammad, Ashraf; Schnakenburg, Gregor; Grimme, Stefan; Schiemann, Olav; Menche, Dirk

    2016-07-04

    Novel types of spin-labeled N,N'-dicyclohexylcarbodiimides (DCC) are reported that bear a 2,2,6,6-tetramethylpiperidinyloxyl (TEMPO) residue on one side and different aromatic and aliphatic cyclohexyl analogues on the other side of the diimide core. These readily available novel reagents add efficiently to aliphatic and aromatic carboxylic acids, forming two possible spin-labeled amide derivatives with different radical distances of the resulting amide. The addition of aromatic DCC analogues proceeds with excellent selectivity, giving amides where the carboxylic acid is exclusively connected to the aromatic residue, while little or no selectivity was observed for the aliphatic congeners. The usefulness of these adducts in structural studies was demonstrated by EPR (electron paramagnetic resonance) measurements of biradical adducts of biphenyl-4,4'-dicarboxylic acids. These analyses also reveal high degrees of conformational bias for aromatic DCC derivatives, which further underlines the powerfulness of these novel reagents. This observation was further corroborated by quantum chemical calculations, giving a detailed understanding of the structural dynamics, while detailed information on the solid state structure of all novel reagents was obtained by X-ray structure analyses.

  8. Martian Feeling: An Analogue Study to Simulate a Round-Trip to Mars using the International Space Station

    Science.gov (United States)

    Felix, C. V.; Gini, A.

    When talking about human space exploration, Mars missions are always present. It is clear that sooner or later, humanity will take this adventure. Arguably the most important aspect to consider for the success of such an endeavour is the human element. The safety of the crew throughout a Martian mission is a top priority for all space agencies. Therefore, such a mission should not take place until all the risks have been fully understood and mitigated. A mission to Mars presents unique human and technological challenges in terms of isolation, confinement, autonomy, reliance on mission control, communication delays and adaptation to different gravity levels. Analogue environments provide the safest way to simulate these conditions, mitigate the risks and evaluate the effects of long-term space travel on the crew. Martian Feeling is one of nine analogue studies, from the Mars Analogue Path (MAP) report [1], proposed by the TP Analogue group of ISU Masters class 2010. It is an integrated analogue study which simulates the psychological, physiological and operational conditions that an international, six-person, mixed gender crew would experience on a mission to Mars. Set both onboard the International Space Station (ISS) and on Earth, the Martian Feeling study will perform a ``dress rehearsal'' of a mission to Mars. The study proposes to test both human performance and operational procedures in a cost-effective manner. Since Low Earth Orbit (LEO) is more accessible than other space-based locations, an analogue studies in LEO would provide the required level of realism to a simulated transit mission to Mars. The sustained presence of microgravity and other elements of true spaceflight are features of LEO that are neither currently feasible nor possible to study in terrestrial analogue sites. International collaboration, economics, legal and ethical issues were considered when the study was proposed. As an example of international collaboration, the ISS would

  9. Structural insights into the interactions of xpt riboswitch with novel guanine analogues: a molecular dynamics simulation study.

    Science.gov (United States)

    Jain, Swapan S; Sonavane, Uddhavesh B; Uppuladinne, Mallikarjunachari V N; McLaughlin, Emily C; Wang, Weiqing; Black, Sheneil; Joshi, Rajendra R

    2015-01-01

    Ligand recognition in purine riboswitches is a complex process requiring different levels of conformational changes. Recent efforts in the area of purine riboswitch research have focused on ligand analogue binding studies. In the case of the guanine xanthine phosphoribosyl transferase (xpt) riboswitch, synthetic analogues that resemble guanine have the potential to tightly bind and subsequently influence the genetic expression of xpt mRNA in prokaryotes. We have carried out 25 ns Molecular Dynamics (MD) simulation studies of the aptamer domain of the xpt G-riboswitch in four different states: guanine riboswitch in free form, riboswitch bound with its cognate ligand guanine, and with two guanine analogues SJ1 and SJ2. Our work reveals novel interactions of SJ1 and SJ2 ligands with the binding core residues of the riboswitch. The ligands proposed in this work bind to the riboswitch with greater overall stability and lower root mean square deviations and fluctuations compared to guanine ligand. Reporter gene assay data demonstrate that the ligand analogues, upon binding to the RNA, lower the genetic expression of the guanine riboswitch. Our work has important implications for future ligand design and binding studies in the exciting field of riboswitches.

  10. Environment-responsive fluorescent nucleoside analogue probe for studying oligonucleotide dynamics in a model cell-like compartment.

    Science.gov (United States)

    Pawar, Maroti G; Srivatsan, Seergazhi G

    2013-11-21

    The majority of fluorescent nucleoside analogue probes that have been used in the in vitro study of nucleic acids are not suitable for cell-based biophysical assays because they exhibit excitation maxima in the UV region and low quantum yields within oligonucleotides. Therefore, we propose that the photophysical characterization of oligonucleotides labeled with a fluorescent nucleoside analogue in reverse micelles (RM), which are good biological membrane models and UV-transparent, could provide an alternative approach to studying the properties of nucleic acids in a cell-like confined environment. In this context, we describe the photophysical properties of an environment-sensitive fluorescent uridine analogue (1), based on the 5-(benzo[b]thiophen-2-yl)pyrimidine core, in micelles and RM. The emissive nucleoside, which is polarity- and viscosity-sensitive, reports the environment of the surfactant assemblies via changes in its fluorescence properties. The nucleoside analogue, incorporated into an RNA oligonucleotide and hybridized to its complementary DNA and RNA oligonucleotides, exhibits a significantly higher fluorescence intensity, lifetime, and anisotropy in RM than in aqueous buffer, which is consistent with the environment of RM. Collectively, our results demonstrate that nucleoside 1 could be utilized as a fluorescent label to study the function of nucleic acids in a model cellular milieu.

  11. Functional magnetic resonance imaging studies of language.

    Science.gov (United States)

    Small, Steven L; Burton, Martha W

    2002-11-01

    Functional neuroimaging of language builds on almost 150 years of study in neurology, psychology, linguistics, anatomy, and physiology. In recent years, there has been an explosion of research using functional imaging technology, especially positron emission tomography (PET) and functional magnetic resonance imaging (fMRI), to understand the relationship between brain mechanisms and language processing. These methods combine high-resolution anatomic images with measures of language-specific brain activity to reveal neural correlates of language processing. This article reviews some of what has been learned about the neuroanatomy of language from these imaging techniques. We first discuss the normal case, organizing the presentation according to the levels of language, encompassing words (lexicon), sound structure (phonemes), and sentences (syntax and semantics). Next, we delve into some unusual language processing circumstances, including second languages and sign languages. Finally, we discuss abnormal language processing, including developmental and acquired dyslexia and aphasia.

  12. Deposition of latex colloids at rough mineral surfaces: an analogue study using nanopatterned surfaces.

    Science.gov (United States)

    Krishna Darbha, Gopala; Fischer, Cornelius; Michler, Alex; Luetzenkirchen, Johannes; Schäfer, Thorsten; Heberling, Frank; Schild, Dieter

    2012-04-24

    Deposition of latex colloids on a structured silicon surface was investigated. The surface with well-defined roughness and topography pattern served as an analogue for rough mineral surfaces with half-pores in the submicrometer size. The silicon topography consists of a regular pit pattern (pit diameter = 400 nm, pit spacing = 400 nm, pit depth = 100 nm). Effects of hydrodynamics and colloidal interactions in transport and deposition dynamics of a colloidal suspension were investigated in a parallel plate flow chamber. The experiments were conducted at pH ∼ 5.5 under both favorable and unfavorable adsorption conditions using carboxylate functionalized colloids to study the impact of surface topography on particle retention. Vertical scanning interferometry (VSI) was applied for both surface topography characterization and the quantification of colloidal retention over large fields of view. The influence of particle diameter variation (d = 0.3-2 μm) on retention of monodisperse as well as polydisperse suspensions was studied as a function of flow velocity. Despite electrostatically unfavorable conditions, at all flow velocities, an increased retention of colloids was observed at the rough surface compared to a smooth surface without surface pattern. The impact of surface roughness on retention was found to be more significant for smaller colloids (d = 0.3, 0.43 vs. 1, 2 μm). From smooth to rough surfaces, the deposition rate of 0.3 and 0.43 μm colloids increased by a factor of ∼2.7 compared to a factor of 1.2 or 1.8 for 1 and 2 μm colloids, respectively. For a substrate herein, with constant surface topography, the ratio between substrate roughness and radius of colloid, Rq/rc, determined the deposition efficiency. As Rq/rc increased, particle-substrate overall DLVO interaction energy decreased. Larger colloids (1 and 2 μm) beyond a critical velocity (7 × 10(-5) and 3 × 10(-6) m/s) (when drag force exceeds adhesion force) tend to detach from the surface

  13. Indenes and tetralenes analogues attenuates lipopolysaccharide-induced inflammation: An in-vitro and in-vivo study.

    Science.gov (United States)

    Mohanty, Shilpa; Gautam, Yashveer; Maurya, Anil Kumar; Negi, Arvind S; Prakash, Om; Khan, Feroz; Bawankule, Dnyaneshwar Umrao

    2016-02-05

    In an effort to evaluate novel pharmacological activity of 1-chloro-2-formyl indene and tetralene analogues possessing potential antitubercular and antistaphylococcal agents, we explored its anti-inflammatory potential against lipopolysaccharide(LPS)-induced inflammation using in-vitro and in-vivo bioassay. Synthesized analogues significantly inhibited the production and expression of pro-inflammatory cytokines against LPS-induced inflammation in macrophages isolated from mice. Among all the analogues, TAF-5 (1-Chloro-2-formyl-1-tetralene) exhibited most potent anti-inflammatory activity without any cytotoxic effect. We have further evaluated the therapeutic efficacy and safety of TAF-5 in in-vivo system using LPS-induced sepsis, a systemic inflammation model and acute oral toxicity respectively in mice. Oral administration of TAF-5 inhibited the pro-inflammatory cytokines in serum, attenuated the organs injuries and improved host survival in dose dependent manner. Acute oral toxicity study showed TAF-5 is non-toxic at higher dose in mice. These results suggest the suitability of indene and tetralene analogues as new chemical entities for further investigation towards the management of inflammation related diseases.

  14. Nitroglycerin enhances the propagation of cortical spreading depression: comparative studies with sumatriptan and novel kynurenic acid analogues

    Science.gov (United States)

    Knapp, Levente; Szita, Bence; Kocsis, Kitti; Vécsei, László; Toldi, József

    2017-01-01

    Background The complex pathophysiology of migraine is not yet clearly understood; therefore, experimental models are essential for the investigation of the processes related to migraine headache, which include cortical spreading depression (CSD) and NO donor-induced neurovascular changes. Data on the assessment of drug efficacy in these models are often limited, which prompted us to investigate a novel combined migraine model in which an effective pharmacon could be more easily identified. Materials and methods In vivo electrophysiological experiments were performed to investigate the effect of nitroglycerin (NTG) on CSD induced by KCl application. In addition, sumatriptan and newly synthesized neuroactive substances (analogues of the neuromodulator kynurenic acid [KYNA]) were also tested. Results The basic parameters of CSDs were unchanged following NTG administration; however, propagation failure was decreased compared to the controls. Sumatriptan decreased the number of CSDs, whereas propagation failure was as minimal as in the NTG group. On the other hand, both of the KYNA analogues restored the ratio of propagation to the control level. Discussion The ratio of propagation appeared to be the indicator of the effect of NTG. This is the first study providing direct evidence that NTG influences CSD; furthermore, we observed different effects of sumatriptan and KYNA analogues. Sumatriptan changed the generation of CSDs, whereas the analogues acted on the propagation of the waves. Our experimental design overlaps with a large spectrum of processes present in migraine pathophysiology, and it can be a useful experimental model for drug screening. PMID:28053504

  15. Phenylpropanoid Glycoside Analogues: Enzymatic Synthesis, Antioxidant Activity and Theoretical Study of Their Free Radical Scavenger Mechanism

    Science.gov (United States)

    López-Munguía, Agustín; Hernández-Romero, Yanet; Pedraza-Chaverri, José; Miranda-Molina, Alfonso; Regla, Ignacio; Martínez, Ana; Castillo, Edmundo

    2011-01-01

    Phenylpropanoid glycosides (PPGs) are natural compounds present in several medicinal plants that have high antioxidant power and diverse biological activities. Because of their low content in plants (less than 5% w/w), several chemical synthetic routes to produce PPGs have been developed, but their synthesis is a time consuming process and the achieved yields are often low. In this study, an alternative and efficient two-step biosynthetic route to obtain natural PPG analogues is reported for the first time. Two galactosides were initially synthesized from vanillyl alcohol and homovanillyl alcohol by a transgalactosylation reaction catalyzed by Kluyveromyces lactis β-galactosidase in saturated lactose solutions with a 30%–35% yield. To synthesize PPGs, the galactoconjugates were esterified with saturated and unsaturated hydroxycinnamic acid derivatives using Candida antarctica Lipase B (CaL-B) as a biocatalyst with 40%–60% yields. The scavenging ability of the phenolic raw materials, intermediates and PPGs was evaluated by the 2,2-diphenyl-1-picrylhydrazyl radical (DPPH•) method. It was found that the biosynthesized PPGs had higher scavenging abilities when compared to ascorbic acid, the reference compound, while their antioxidant activities were found similar to that of natural PPGs. Moreover, density functional theory (DFT) calculations were used to determine that the PPGs antioxidant mechanism proceeds through a sequential proton loss single electron transfer (SPLET). The enzymatic process reported in this study is an efficient and versatile route to obtain PPGs from different phenylpropanoid acids, sugars and phenolic alcohols. PMID:21674039

  16. Study of spin resonances in the accelerators with snakes

    Energy Technology Data Exchange (ETDEWEB)

    Lee, S.Y. (Brookhaven National Laboratory, Upton, NY 11973 (USA))

    1989-05-05

    Spin resonances in the circular accelerators with snakes are studied to understand the nature of snake resonances. We analyze the effect of snake configuration, and the snake superperiod on the resonance. Defining the {ital critical} {ital resonance} {ital strength} {epsilon}{sub {ital c}} as the maximum tolerable resonance strength without losing the beam polarization after passing through the resonance, we found that {epsilon}{sub {ital c}} is a sensitive function of the snake configuration, the snake superperiod at the first order snake resonance, the higher order snake resonance conditions and the spin matching condition. Under properly designed snake configuration, the critical resonance strength {epsilon}{sub {ital c}} is found to vary linearly with {ital N}{sub {ital S}} as {l angle}{epsilon}{sub {ital c}}{r angle}=(1/{pi})sin{sup {minus}1}(cos {pi}{nu}{sub z}{vert bar}{sup 1/2})N{sub S}, where {nu}{vert bar}{sub z} and N{sub S} are the betatron tune and the number of snakes respectively. We also study the effect of overlapping intrinsic and imperfection resonances. The imperfection resonance should be corrected to a magnitude of insignificance (e.g., {epsilon}{le}0.1 for two snakes case) to maintain proper polarization.

  17. Mechanism of escape, extrasystolic, and parasystolic arrhythmias. Study on an electrical analogue.

    Science.gov (United States)

    Sideris, D A

    1976-01-01

    A simple analogue of the heart consisting of a system of neon relaxation oscillators is presented. The analogue may display rhythm patterns similar to sinus rhythm, escape rhythm, isorrhythmic dissociation with synchronization, atrial extrasystoles, ventricular extrasystoles, and parasystole. The strict rules followed by these arrhythmias, as well as the deviations from the rules commonly followed by the equivalent heart arrhythmias, may be easily reproduced on the analogue. Such features are the Treppe phenomenon and captured beats in escape rhythm, fixed coupling intervals in extrasystoles, partial or complete atrioventricular block in very premature atrial extrasystoles, prolongation of the period following an atrial extrasystole, interpolated premature beats, complete compensatory pause and the rule of bigeminy in ventricular extrasystoles, slight instability of the parasystolic period, multiple length parasystolic periods slightly different from the exact multiples of the parasystolic idioperiod, preference of the parasystoles for certain phase in the sinus cycle, synchronization at a phase difference and fluctuation repeatedly and without interruption from a parasystolic to an extrasystolic rhythm and synchronization in escape rhythm with isorrhythmic dissociation. The mechanisms involved in these phenomena are discussed in detail. The striking similarity between the properties of the cardiac pacemakers and those of the relaxation oscillators on the one hand and betwen the rhythm patterns of the heart and those of the analogue on the other may permit the hypothesis that the mechanisms operating in the analogue may be used in analyzing and understanding heart arrhythmias.

  18. An experimental analogue study into the role of abstract thinking in trauma-related rumination.

    Science.gov (United States)

    Ehring, Thomas; Szeimies, Anna-Kristina; Schaffrick, Christina

    2009-04-01

    Trauma-related rumination has been shown to predict the maintenance of posttraumatic stress disorder (PTSD). However, it is still unclear how rumination can be distinguished from functional forms of thinking about traumatic events. The current study used an analogue design to experimentally test the hypothesis that the abstractness of thinking is responsible for the dysfunctional effects of trauma-related rumination. Eighty-three healthy university students first watched a distressing video and were then randomly assigned to abstract ruminative thinking, concrete thinking or distraction. Abstract thinking was found to lead to a significantly longer maintenance of negative mood and arousal than both concrete thinking and distraction. These results are in line with earlier findings in the context of excessive worry and depressive rumination and support the view that abstractness is a critical factor for the dysfunctional effects of trauma-related rumination. However, results regarding intrusive memories were not supportive of the hypotheses. Unexpectedly, the distraction group showed the highest number of intrusions, whereas the abstract and concrete conditions did not significantly differ. Implications for theoretical models of trauma-related rumination and possible clinical implications are discussed.

  19. Theoretical study on the reactive sites and intramolecular interactions in taxol and its four analogues

    Science.gov (United States)

    Zhou, Hongwei; Zhang, Zhiqiang; Cheung, Hon-Yeung

    A density-functional study of the paclitaxel (Taxol) molecule and its four analogues has been performed. The theory of Bader's atoms in molecules (AIM) was applied to examine the electronic structure of these molecules at their ground state. Topological analysis reveals that the esterification of hydroxyl group attached to the oxetane ring results in great change of conformation of the taxane ring, and thus is responsible for bioactivity of the oxetane oxygen atom. It was found that there exists some intramolecular interactions in the molecule, including normal hydrogen bonds (HBs) and double HBs. Visualization of the molecule shows that the central bodies (the four fused rings) of the molecules are wrapped by the intramolecular interactions. It is supposed that these intramolecular interactions lower the aqueous solubility and protect the flexible oxetane ring, which is regarded as the dominating bioactivity site of the drug, from being opened. Our results provide an extended and consistent set of data to gauge classical force fields in view of the atomistic investigations of the interaction of the bioactive molecules.

  20. Studies of the ADP/ATP carrier of mitochondria with fluorescent ADP analogue formycin diphosphate.

    Science.gov (United States)

    Graue, C; Klingenberg, M

    1979-06-05

    The ADP/ATP carrier was studied by a fluorescent substrate, formycin diphosphate which is the only fluorescent ADP analogue to bind. Its low quantum yield, short decay time and spectral overlap with tryptophan has as yet prevented its wider use. By incorporating fluorescent acceptors of formycin diphosphate fluorescence, anthracene-maleimide and vinylanthracene, into the membrane, these difficulties were circumvented. Only bound formycin diphosphate transfers energy to the probes so that the secondary emission of these probes is a measure for membrane-bound formycin diphosphate. The fluorescent transfer is inhibited by ADP, bongkrekate and carboxyatractylate whether added before or after incubation of formycin diphosphate showing that only binding to the adenine nucleotide carrier is measured. It also shows directly that the earlier demonstrated ADP fixation by bongkrekate is indeed a displacement into the matrix. The fluorescence decay time of the bound formycin diphosphate is measured as 1.95 ns compared to 0.95 ns of the free formycin diphosphate, indicating that formycin diphosphate is bound at the carrier in a non-polar environment. The depolarization decay time was found to be larger than 15 ns, indicating that carrier-bound formycin diphosphate is immobile within this time period.

  1. Nitroglycerin enhances the propagation of cortical spreading depression: comparative studies with sumatriptan and novel kynurenic acid analogues

    Directory of Open Access Journals (Sweden)

    Knapp L

    2016-12-01

    Full Text Available Levente Knapp,1 Bence Szita,1 Kitti Kocsis,1,2 László Vécsei,2,3 József Toldi1,2 1Department of Physiology, Anatomy, and Neuroscience, University of Szeged, 2MTA-SZTE Neuroscience Research Group, 3Department of Neurology, Faculty of Medicine, Albert Szent-Györgyi Clinical Centre, University of Szeged, Szeged, Hungary Background: The complex pathophysiology of migraine is not yet clearly understood; therefore, experimental models are essential for the investigation of the processes related to migraine headache, which include cortical spreading depression (CSD and NO donor-induced neurovascular changes. Data on the assessment of drug efficacy in these models are often limited, which prompted us to investigate a novel combined migraine model in which an effective pharmacon could be more easily identified. Materials and methods: In vivo electrophysiological experiments were performed to investigate the effect of nitroglycerin (NTG on CSD induced by KCl application. In addition, sumatriptan and newly synthesized neuroactive substances (analogues of the neuromodulator kynurenic acid [KYNA] were also tested. Results: The basic parameters of CSDs were unchanged following NTG administration; however, propagation failure was decreased compared to the controls. Sumatriptan decreased the number of CSDs, whereas propagation failure was as minimal as in the NTG group. On the other hand, both of the KYNA analogues restored the ratio of propagation to the control level. Discussion: The ratio of propagation appeared to be the indicator of the effect of NTG. This is the first study providing direct evidence that NTG influences CSD; furthermore, we observed different effects of sumatriptan and KYNA analogues. Sumatriptan changed the generation of CSDs, whereas the analogues acted on the propagation of the waves. Our experimental design overlaps with a large spectrum of processes present in migraine pathophysiology, and it can be a useful experimental model

  2. NUCLEAR MAGNETIC RESONANCE STUDIES OF URANOCENES

    Energy Technology Data Exchange (ETDEWEB)

    Luke, Wayne D.; Streitwieser, Jr., Andrew

    1979-12-01

    In the past several years a substantial amount of work has been devoted toward evaluation of the contact and pseudocontact contributions to the observed isotropic shifts in H nuclear magnetic resonance (NMR) spectra of uranium(IV) organometallic compounds. One reason for interest in this area arises from using the presence of contact shifts as a prcbe for covalent character in the uranium carbon bonds in these compounds. Several extensive {sup 1}H NNR studies on Cp{sub 3} U-X compounds and less extensive studies on uranocenes have been reported. Interpretation of these results suggests that contact shifts-contribute significantly to the observed isotropic shifts. Their presence has been taken as indicative of covalent character of metal carbon bonds in these systems, but agreement is not complete. In this paper we shall review critically the work reported on uranocenes in the light of recent results and report recent work on attempted separation of the observed isotropic shifts in alkyluranocenes into contact and pseudocontact components.

  3. A study of trapped mode resonances in asymmetric X-shape resonator for frequency selective surface

    Science.gov (United States)

    Chen, Kejian; Liu, Hong; Wang, Yiqi; Zhu, Yiming

    2013-08-01

    FSS is a two-dimensional periodic array of resonating metallic-dielectric structures, When FSS device steps into Terahertz range from microwave range, it is studied as THz functional components (such as Terahertz filter, Terahertz biochemical sensor, etc.) to promote the functionality of the THz spectroscopy/imaging system. When the device requires a narrow band transmission window for frequency selecting or a high electric field concentration in certain area to improve its sensitivity for sensing, normally, a high quality (Q) resonant structure can give helps. Recently, high-Q resonance induced by trapped mode resonance i studied widely in FSS research areas. To induce trapped mode resonance, one can simply break the symmetric of the unit structure of FSS. In this paper, several asymmetric X-shaped resonators for FSS working in terahertz range have been studied numerically. To compare the behaviour of X-shape resonator under different conditions (with additional part: Heart lines, Shoulder lines, Wrap or Shoes squares), a common platform (θ=60, θis angle of X shape) which is suitable for most of cases was used to make the study more meaningful. As the field enhancement behaviour is related to the trapped mode introduced by the asymmetric structure, we propose such kind of device to be used as a high quality filter or as a sensing element for biochemical samples.

  4. Numerical study of transient nonlinear harbor resonance

    Institute of Scientific and Technical Information of China (English)

    2010-01-01

    It is generally accepted that nonlinear wave-wave interactions play an important role in harbor resonance. Nevertheless it is not clear how waves take part in those interactions. The aim of this paper is to investigate those processes for a rectangular harbor at transient phases. Long-period oscillations excited by bichromatic waves are simulated by the Boussinesq model. The simulations start from calm conditions for the purpose of studying the response process. The internal wavemaker stops working after the oscillations have reached a quasi-steady state, and it is used to simulate the damp process. In order to analyze temporary features of wave-wave interactions in different states, the wavelet-based bispectrum is employed. The influence of the short wave frequencies on long-period oscillations is investigated, and reasons are tried to be given from nonlinear triad interactions between different wave components and the interaction of short waves and the bay entrance. Finally, the response time and the damp time are estimated by a simple method.

  5. Gas geochemistry of natural analogues for the studies of geological CO{sub 2} sequestration

    Energy Technology Data Exchange (ETDEWEB)

    Voltattorni, N., E-mail: nunzia.voltattorni@ingv.it [Istituto Nazionale di Geofisica e Vulcanologia, Via di Vigna Murata no 605, 00143 Rome (Italy); Sciarra, A. [Istituto Nazionale di Geofisica e Vulcanologia, Via di Vigna Murata no 605, 00143 Rome (Italy); Caramanna, G. [Earth Science Dep., University ' La Sapienza' , Piazzale A. Moro no 5, 00185 Rome (Italy); Cinti, D.; Pizzino, L.; Quattrocchi, F. [Istituto Nazionale di Geofisica e Vulcanologia, Via di Vigna Murata no 605, 00143 Rome (Italy)

    2009-07-15

    Geological sequestration of anthropogenic CO{sub 2} appears to be a promising method for reducing the amount of greenhouse gases released to the atmosphere. Geochemical modelling of the storage capacity for CO{sub 2} in saline aquifers, sandstones and/or carbonates should be based on natural analogues both in situ and in the laboratory. The main focus of this paper has been to study natural gas emissions representing extremely attractive surrogates for the study and prediction of the possible consequences of leakage from geological sequestration sites of anthropogenic CO{sub 2} (i.e., the return to surface, potentially causing localised environmental problems). These include a comparison among three different Italian case histories: (i) the Solfatara crater (Phlegraean Fields caldera, southern Italy) is an ancient Roman spa. The area is characterised by intense and diffuse hydrothermal activity, testified by hot acidic mud pools, thermal springs and a large fumarolic field. Soil gas flux measurements show that the entire area discharges between 1200 and 1500 tons of CO{sub 2} per day; (ii) the Panarea Island (Aeolian Islands, southern Italy) where a huge submarine volcanic-hydrothermal gas burst occurred in November, 2002. The submarine gas emissions chemically modified seawater causing a strong modification of the marine ecosystem. All of the collected gases are CO{sub 2}-dominant (maximum value: 98.43 vol.%); (iii) the Tor Caldara area (Central Italy), located in a peripheral sector of the quiescent Alban Hills volcano, along the faults of the Ardea Basin transfer structure. The area is characterised by huge CO{sub 2} degassing both from water and soil. Although the above mentioned areas do not represent a storage scenario, these sites do provide many opportunities to study near-surface processes and to test monitoring methodologies.

  6. Phase transitions in mixed-valence potassium manganese hexacyanoferrate Prussian blue analogue: Heat capacity calorimetric study

    Energy Technology Data Exchange (ETDEWEB)

    Bhattacharjee, A. [Department of Physics, Visva-Bharati, Santiniketan 731235 (India)]. E-mail: ashis@vbphysics.net.in; Saha, S. [Department of Chemistry, Jadavpur University, Kolkata 700032 (India); Koner, S. [Department of Chemistry, Jadavpur University, Kolkata 700032 (India); Miyazaki, Y. [Research Center for Molecular Thermodynamics, Graduate School of Science, Osaka University, Toyonaka, Osaka 560-0043 (Japan)]. E-mail: miyazaki@chem.sci.osaka-u.ac.jp

    2007-05-15

    Phase transitions in K{sub 0.2}Mn{sub 0.66}{sup II}Mn{sub 1.44}{sup III}[Fe{sub 0.2}{sup II}Fe{sub 0.8}{sup III}(CN){sub 6}]O{sub 0.6}= {sub 6}(CH{sub 3}COO){sub 1.32}].7.6H{sub 2}O-a mixed valence PB analogue have been investigated with the help of heat capacity calorimetry under 0-90kOe magnetic fields in the 1.8-300K temperature range. Two heat capacity anomalies at 2.1 and 7.5K have been detected, which correspond to ferromagnetic and ferrimagnetic transitions, respectively. The magnitudes as well as the position of these thermal anomalies have varied with changing magnetic field. The estimated zero-field magnetic entropy amounted to 29.2JK{sup -1}mol{sup -1}, which is close to the expected value (33.7JK{sup -1}mol{sup -1}). The uniaxial zero-field splitting parameter is estimated to be D/k{sub B}=14.7K. A comparatively stronger antiferromagnetic interaction seems to lead to the magnetic transition around 7.3K, whereas a weaker ferromagnetic interaction gives rise to the thermal anomaly at 2.1K. The present results on magnetic phase transitions are in complete agreement with the earlier observations made through magnetic studies. Additionally, a glass transition at 194K has been observed in the heat capacity study presumably due to freezing of the orientational motion of the H{sub 2}O molecules present in the material. This phenomenon is reflected into the temperature dependence of the estimated Fe{sup III} and Fe{sup II} concentrations in the present material obtained earlier through Mossbauer spectroscopy.

  7. Feasibility Study of Analogue and Digital Temperature Sensors in Nanoscale CMOS Technologies

    NARCIS (Netherlands)

    Geljon, M.; Sill, F.; De Lima Monteiro, D.W.

    2009-01-01

    The downscaling of CMOS technology gives rise to a myriad of nanoscale effects. At the same time, power density and thus heat generation increases. The aim of this paper is to evaluate the feasibility of both analogue and digital temperature sensors in nanoscale CMOS using the Berkeley Predictive Te

  8. Biostructural and pharmacological studies of bicyclic analogues of the 3-isoxazolol glutamate receptor agonist ibotenic acid

    DEFF Research Database (Denmark)

    Frydenvang, Karla Andrea; Pickering, Darryl S; Greenwood, Jeremy R;

    2010-01-01

    We describe an improved synthesis and detailed pharmacological characterization of the conformationally restricted analogue of the naturally occurring nonselective glutamate receptor agonist ibotenic acid (RS)-3-hydroxy-4,5,6,7-tetrahydroisoxazolo[5,4-c]pyridine-7-carboxylic acid (7-HPCA, 5) at A...

  9. Study of acoustic resonance of cascades

    Science.gov (United States)

    Honjo, M.; Tominaga, T.

    Discrete sounds and vibrations from guide vanes due to acoustic resonance in the vane flow path, are experimentally investigated. Other causes of pure sounds in stationary vanes are considered, such as direct radiation from wake shedding vortices, bubble vortices or leading edges, and radial or axial modes of air columns. Two-dimensional cascade tests are performed under various conditions, and the data are compared with theoretical results of flat plate cascades. Three-dimensional ducted guide vane model tests are carried out to apply prototype guide vanes, and to confirm the resonance of the two-dimensional tests. Results show that frequency is more sensitive to chord length than pitch length, and the ratio of the fluctuation frequency to fluid sound velocity/pitch length is independent of the scale. Bubble vortices on concave surfaces or leading edges are not exciting sources; and under the limit of solidity, no exciting energy can generate acoustic resonance in correspondence to the mode.

  10. Laser-Raman and FT-IR spectroscopic studies of peptide-analogues of silkmoth chorion protein segments.

    Science.gov (United States)

    Benaki, D C; Aggeli, A; Chryssikos, G D; Yiannopoulos, Y D; Kamitsos, E I; Brumley, E; Case, S T; Boden, N; Hamodrakas, S J

    1998-07-01

    Silkmoth chorion, the proteinaceous major component of the eggshell, with extraordinary mechanical and physiological properties, consists of a complex set of proteins, which have a tripartite structure: a central, evolutionarily conserved, domain and two more variable 'arms'. Peptide-analogues of silkmoth chorion protein central domain segments have been synthesized. Laser-Raman and infrared spectroscopic studies suggest the preponderance of antiparallel beta-pleated sheet structure for these peptides, both in solution and in the solid state.

  11. Novel Penicillin Analogues as Potential Antimicrobial Agents; Design, Synthesis and Docking Studies.

    Directory of Open Access Journals (Sweden)

    Zaman Ashraf

    Full Text Available A number of penicillin derivatives (4a-h were synthesized by the condensation of 6-amino penicillinic acid (6-APA with non-steroidal anti-inflammatory drugs as antimicrobial agents. In silico docking study of these analogues was performed against Penicillin Binding Protein (PDBID 1CEF using AutoDock Tools 1.5.6 in order to investigate the antimicrobial data on structural basis. Penicillin binding proteins function as either transpeptidases or carboxypeptidases and in few cases demonstrate transglycosylase activity in bacteria. The excellent antibacterial potential was depicted by compounds 4c and 4e against Escherichia coli, Staphylococcus epidermidus and Staphylococcus aureus compared to the standard amoxicillin. The most potent penicillin derivative 4e exhibited same activity as standard amoxicillin against S. aureus. In the enzyme inhibitory assay the compound 4e inhibited E. coli MurC with an IC50 value of 12.5 μM. The docking scores of these compounds 4c and 4e also verified their greater antibacterial potential. The results verified the importance of side chain functionalities along with the presence of central penam nucleus. The binding affinities calculated from docking results expressed in the form of binding energies ranges from -7.8 to -9.2kcal/mol. The carboxylic group of penam nucleus in all these compounds is responsible for strong binding with receptor protein with the bond length ranges from 3.4 to 4.4 Ǻ. The results of present work ratify that derivatives 4c and 4e may serve as a structural template for the design and development of potent antimicrobial agents.

  12. Revisiting sesquiterpene biosynthetic pathways leading to santalene and its analogues: a comprehensive mechanistic study.

    Science.gov (United States)

    Jindal, Garima; Sunoj, Raghavan B

    2012-10-21

    Santalene and bergamotene are the major olefinic sesquiterpenes responsible for the fragrance of sandalwood oil. Herein we report the details of density functional theory investigations on the biosynthetic pathway of this important class of terpenes. The mechanistic study has been found to be effective toward gaining significant new insight into different possibilities for the formation of the key intermediates involved in santalene and bergamotene biosynthesis. The stereoelectronic features of the transition states and intermediates for (i) ring closure of the initial bisabolyl cation, and (ii) skeletal rearrangements in the ensuing bicyclic carbocationic intermediates leading to (-)-epi-β-santalene, (-)-β-santalene, (-)-α-santalene, (+)-epi-β-santalene, exo-β-bergamotene, endo-β-bergamotene, exo-α-bergamotene, and endo-α-bergamotene are presented. Interesting structural features pertaining to certain new carbocationic intermediates (such as b) resulting from the ring closure of bisabolyl cation are discussed. Extensive conformational sampling of all key intermediates along the biosynthetic pathway offered new insight into the role of the isoprenyl side chain conformation in the formation of santalene and its analogues. Although the major bicyclic products in Santalum album appear to arise from the right or left handed helical form of farnesyl pyrophosphate (FPP), different alternatives for their formation are found to be energetically feasible. The interconversion of the exo and endo isomers of bisabolyl cation and a likely epimerization, both with interesting mechanistic implications, are presented. The exo to endo conversion is identified to be energetically more favorable than another pathway emanating from the left handed helical FPP. The role of pyrophosphate (OPP(-)) in the penultimate deprotonation step leading to olefinic sesquiterpenes is also examined.

  13. Resonance raman studies of phenylcyclopropane radical cations

    NARCIS (Netherlands)

    Godbout, J.T.; Zuilhof, H.; Heim, G.; Gould, I.R.; Goodman, J.L.; Dinnocenzo, J.P.; Myers Kelley, A.

    2000-01-01

    Resonance Raman spectra of the radical cations of phenylcyclopropane and trans-1-phenyl-2-methylcyclopropane are reported. A near-UV pump pulse excites a photosensitizer which oxidizes the species of interest, and a visible probe pulse delayed by 35 ns obtains the spectrum of the radical ion. The tr

  14. Nuclear Magnetic Resonance Technology for Medical Studies.

    Science.gov (United States)

    Budinger, Thomas F.; Lauterbur, Paul C.

    1984-01-01

    Reports on the status of nuclear magnetic resonance (NMR) from theoretical and clinical perspectives, reviewing NMR theory and relaxation parameters relevant to NMR imaging. Also reviews literature related to modern imaging strategies, signal-to-noise ratio, contrast agents, in vivo spectroscopy, spectroscopic imaging, clinical applications, and…

  15. Surface Plasmon Resonance Studies on Molecular Imprinting

    Directory of Open Access Journals (Sweden)

    Baoping Lin

    2002-01-01

    Full Text Available The molecular imprinted polymer (MIP members were fabricated with the print molecule L-phenylalanine ethyl ester. The elution and adsorption procedures were investigated by surface plasmon resonance in situ. The changes of refractive angle during elution procedure suggest that the MIP is prepared on the base of the non-covalent interactions. This MIP member sensor can achieve enantioselective recognition.

  16. Resonances

    DEFF Research Database (Denmark)

    an impetus or drive to that account: change, innovation, rupture, or discontinuity. Resonances: Historical Essays on Continuity and Change explores the historiographical question of the modes of interrelation between these motifs in historical narratives. The essays in the collection attempt to realize...... theoretical consciousness through historical narrative ‘in practice’, by discussing selected historical topics from Western cultural history, within the disciplines of history, literature, visual arts, musicology, archaeology, philosophy, and theology. The title Resonances indicates the overall perspective...

  17. Fokker-Planck Study of Tokamak Electron Cyclotron Resonance Heating

    Institute of Scientific and Technical Information of China (English)

    SHIBingren; LONGYongxing; DONGJiaqi; LIWenzhong; JIAOYiming; WANGAike

    2002-01-01

    In this study, we add a subroutine for describing the electron cyclotron resonant heating calculation to the Fokker-Planck code. By analyzing the wave-particle resonance condition in tokamak plasma and the fast motion of electrons along magnetic field lines, suitable quasi-linear diffusion coefficients are given.

  18. Mutation of a conserved residue enhances the sensitivity of analogue-sensitised kinases to generate a novel approach to the study of mitosis in fission yeast.

    Science.gov (United States)

    Tay, Ye-Dee; Patel, Avinash; Kaemena, Daniel F; Hagan, Iain M

    2013-11-01

    The chemical genetic strategy in which mutational enlargement of the ATP-binding site sensitises of a protein kinase to bulky ATP analogues has proved to be an elegant tool for the generation of conditional analogue-sensitive kinase alleles in a variety of model organisms. Here, we describe a novel substitution mutation in the kinase domain that can enhance the sensitivity of analogue-sensitive kinases. Substitution of a methionine residue to phenylalanine in the +2 position after HRDLKxxN motif of the subdomain VIb within the kinase domain markedly increased the sensitivities of the analogue-sensitive kinases to ATP analogues in three out of five S. pombe kinases (i.e. Plo1, Orb5 and Wee1) that harbor this conserved methionine residue. Kinome alignment established that a methionine residue is found at this site in 5-9% of kinases in key model organisms, suggesting that a broader application of this structural modification may enhance ATP analogue sensitivity of analogue-sensitive kinases in future studies. We also show that the enhanced sensitivity of the wee1.as8 allele in a cdc25.22 background can be exploited to generate highly synchronised mitotic and S phase progression at 36°C. Proof-of-principle experiments show how this novel synchronisation technique will prove of great use in the interrogation of the mitotic or S-phase functions through temperature sensitivity mutation of molecules of interest in fission yeast.

  19. Use of 3-aminopropanol as an ethanolamine analogue in the study of phospholipid metabolism in Tetrahymena.

    Science.gov (United States)

    Smith, J D; Barrows, L J

    1988-01-01

    About 50% of the ethanolamine in phosphatidylethanolamine in Tetrahymena is replaced by 3-aminopropan-1-ol when the compound is added to the growth medium. The phosphatidylpropanolamine which is formed is not converted into the corresponding phosphatidylcholine analogue by methylation. There is an increase in phosphatidylcholine formed by the phosphotransferase pathway from free [3H]choline and a decrease in the phosphatidylcholine formed by the methylation pathway from [14C]methionine. The nature of the observed phospholipid alterations suggests that the regulation of phosphatidylcholine biosynthesis in Tetrahymena may be different from that found in higher eukaryotes. Images Fig. 1. PMID:3178752

  20. The project De Caldas International Project: An example of a large-scale radwaste isolation natural analogue study

    Energy Technology Data Exchange (ETDEWEB)

    Shea, M. [TerraCon, Inc., Chicago, IL (United States)

    1995-09-01

    The proper isolation of radioactive waste is one of today`s most pressing environmental issues. Research is being carried out by many countries around the world in order to answer critical and perplexing questions regarding the safe disposal of radioactive waste. Natural analogue studies are an increasingly important facet of this international research effort. The Pocos de Caldas Project represents a major effort of the international technical and scientific community towards addressing one of modern civilization`s most critical environmental issues - radioactive waste isolation.

  1. [Study of Fermi resonance by means of solution concentration variation].

    Science.gov (United States)

    Jiang, Xiu-lan; Li, Dong-fei; Chen, Yuan-zheng; Zhou, Mi; Sun, Cheng-lin; Yang, Guang; Li, Zuo-wei; Gao, Shu-qin

    2011-05-01

    The values of Raman scattering coefficients of some molecules in which Fermi resonance occurs vary with solution concentration variation. We measured the Raman spectra of some solvents such as CCl4, CS2, C6H6, etc by changing the concentration of the solutions ranging from 10% to 100% in volume. As a result, the authors obtained the general law of Fermi resonance. We found some weak Fermi resonance phenomena as well that the two bands of Raman spectrum shift asymmetrically and that the fundamental of overtone is tuned by Fermi resonance and moves towards the same direction with the overtone simultaneously, which is same as the results Bier K. D. obtained by means of high-pressure technique. By means of this method, the authors demonstrated the conclusion that only the fundamental in combinations which has the same symmetry as the fundamental involved in Fermi resonance directly can its intensity variation influence the Fermi resonance. In this article, the authors present a new method to study Fermi resonance. This method is valuable in the identification and the assignment of spectral lines of solutions, the determination of molecular configuration of enzyme, the discrimination of isomer, as well as the influences on the molecular structures and properties caused by hydrogen bond.

  2. Extending the structure-activity relationship study of marine natural ningalin B analogues as P-glycoprotein inhibitors.

    Science.gov (United States)

    Yang, Chao; Wong, Iris L K; Peng, Kai; Liu, Zhen; Wang, Peng; Jiang, Tingfu; Jiang, Tao; Chow, Larry M C; Wan, Sheng Biao

    2017-01-05

    In the present study, a total of 25 novel ningalin B analogues were synthesized and evaluated for their P-gp modulating activity in a P-gp overexpressed breast cancer cell line LCC6MDR. Preliminary structure-activity study shows that A ring and its two methoxy groups are important pharmacophores for P-gp inhibiting activity. Among all derivatives, 23 is the most potent P-gp modulator with EC50 of 120-165 nM in reversing paclitaxel, DOX, vinblastine and vincristine resistance. It is relatively safe to use with selective index at least greater than 606 compared to verapamil. Mechanistic study demonstrates that compound 23 reverses P-gp mediated drug resistance by inhibiting transport activity of P-gp, thereby restoring intracellular drug accumulation. In summary, our study demonstrates that ningalin B analogue 23 is a non-cytotoxic and effective P-gp chemosensitizer that can be used in the future for reversing P-gp mediated clinical cancer drug resistance.

  3. Studying Z-DNA and B- to Z-DNA transitions using a cytosine analogue FRET-pair.

    Science.gov (United States)

    Dumat, Blaise; Larsen, Anders Foller; Wilhelmsson, L Marcus

    2016-06-20

    Herein, we report on the use of a tricyclic cytosine FRET pair, incorporated into DNA with different base pair separations, to study Z-DNA and B-Z DNA junctions. With its position inside the DNA structure, the FRET pair responds to a B- to Z-DNA transition with a distinct change in FRET efficiency for each donor/acceptor configuration allowing reliable structural probing. Moreover, we show how fluorescence spectroscopy and our cytosine analogues can be used to determine rate constants for the B- to Z-DNA transition mechanism. The modified cytosines have little influence on the transition and the FRET pair is thus an easily implemented and virtually non-perturbing fluorescence tool to study Z-DNA. This nucleobase analogue FRET pair represents a valuable addition to the limited number of fluorescence methods available to study Z-DNA and we suggest it will facilitate, for example, deciphering the B- to Z-DNA transition mechanism and investigating the interaction of DNA with Z-DNA binding proteins.

  4. Measuring satiety with pictures compared to visual analogue scales. An exploratory study.

    Science.gov (United States)

    Sadoul, Bastien C; Schuring, Ewoud A H; Symersky, Tomas; Mela, David J; Masclee, Ad A M; Peters, Harry P F

    2012-02-01

    Visual analogue scales (VAS) are a standard tool used to measure subjective appetite. To explore a potentially more intuitive and precise alternative, we developed a method based on pictures and assessed its performance characteristics vs. VAS. The objective was to compare the capacity of the two methods to discriminate appetite ratings between interventions. Both methods were applied within a previously published trial in which 16 healthy adults received standardised meals followed by three different ileal infusions in a balanced crossover design. At regular intervals volunteers indicated how many units of individually pictured food portions (for 10 different items) they would like to eat, and also scored six VAS. Methods were compared over different timeframes and assessed for their sensitivity to intervention effects. Pictures were more sensitive than VAS in differentiating intervention effects; however, further refinement and validation would be needed for pictures to become a standardised and accepted alternative to VAS for this type of research.

  5. Primary study of a novel Tc-tricarbonyl cocaine analogue as the potential DAT imaging agent

    Institute of Scientific and Technical Information of China (English)

    ZHANG Xiaobo; ZHU Lin; DING Shaoke; LIU Boli

    2005-01-01

    The convenient preparation of organometallic precursor fac-[99mTc(CO)3 (H2O)3]+ opens a new route to design new radiopharmaceuticals. Based on this precursor, a new cocaine analogue, Tropyn, is designed and synthesized, and "2+1" mixed-ligands approach is used to prepare a neutral complex [99mTc(CO)3(Tropyn)I]. Biodistribution in mice and rats proves that it has sufficient brain uptake. Rat regional brain biodistribution indicates that the complex is highly concentrated in the striatum (ST) with rapid clearance in the cortex (CT) and hippocampus (HP), which make it valuable for further investigation as the potential Second-Generation DAT imaging agent.

  6. Protolytic properties of polyamine wasp toxin analogues studied by 13C NMR spectroscopy

    DEFF Research Database (Denmark)

    Strømgaard, Kristian; Piazzi, Lorna; Olsen, Christian A;

    2006-01-01

    Acid-base properties of the natural polyamine wasp toxin PhTX-433 (1) and seven synthetic analogues [PhTX-343 (2), PhTX-334 (3), PhTX-443 (4), PhTX-434 (5), PhTX-344 (6), PhTX-444 (7), and PhTX-333 (8)], each having four protolytic sites, were characterized by 13C NMR spectroscopy. Nonlinear......, multiparameter, simultaneous fit of all chemical shift data obtained from the NMR titration curves yielded macroscopic pKa values as well as intrinsic chemical shift data of all differently protonated macrospecies. Analyses of the chemical shift data demonstrated strong interactions between all four sites...... and provided information about complex relationships between chemical shift values and protonation state. Deprotonation of fully protonated forms starts at the central amino group of the polyamine moiety, and the extent of this trend depends on the distance to the flanking, protonated amino groups. The pKa1...

  7. Synthesis of radioiodinated naltrindole analogues: Ligands for studies of delta opioid receptors

    Energy Technology Data Exchange (ETDEWEB)

    Kinter, Chris M.; Lever, John R

    1995-07-01

    Analogues of naltrindole and N1'-methylnaltrindole having radioiodine in the 7'-position of the indole ring have been prepared for evaluation as delta opioid receptor ligands. The no-carrier-added radiosyntheses were conducted by Cu(I) assisted nucleophilic exchange of radioiodide for bromide under reducing conditions at 190 deg. C. A combination of HPLC and solid-phase extraction gave the {sup 125}I- or {sup 123}I-labeled products in satisfactory yields (47%) with high radiochemical purities (>98%) and high specific activities ({sup 125}I: 43-68 GBq/{mu}mol, 1155-1833 mCi/{mu}mol; {sup 123}I: > 92 GBq/{mu}mol, 2500 mCi/{mu}mol)

  8. Laboratory simulation and modeling of size, shape distributed interstellar graphite dust analogues: A comparative study

    Science.gov (United States)

    Boruah, Manash J.; Gogoi, Ankur; Ahmed, Gazi A.

    2016-06-01

    The computation of the light scattering properties of size and shape distributed interstellar graphite dust analogues using discrete dipole approximation (DDA) is presented. The light scattering properties of dust particles of arbitrary shapes having sizes ranging from 0.5 to 5.0 μm were computed using DDSCAT 7.3.0 software package and an indigenously developed post-processing tool for size and shape averaging. In order to model realistic samples of graphite dust and compute their light scattering properties using DDA, different target geometries were generated to represent the graphite particle composition in terms of surface smoothness, surface roughness and aggregation or their combination, for using as the target for DDSCAT calculations. A comparison of the theoretical volume scattering function at 543.5 nm and 632.8 nm incident wavelengths with laboratory simulation is also presented in this paper.

  9. Interaction of magnetic resonators studied by the magnetic field enhancement

    Science.gov (United States)

    Hou, Yumin

    2013-12-01

    It is the first time that the magnetic field enhancement (MFE) is used to study the interaction of magnetic resonators (MRs), which is more sensitive than previous parameters-shift and damping of resonance frequency. To avoid the coherence of lattice and the effect of Bloch wave, the interaction is simulated between two MRs with same primary phase when the distance is changed in the range of several resonance wavelengths, which is also compared with periodic structure. The calculated MFE oscillating and decaying with distance with the period equal to resonance wavelength directly shows the retardation effect. Simulation also shows that the interaction at normal incidence is sensitive to the phase correlation which is related with retardation effect and is ultra-long-distance interaction when the two MRs are strongly localized. When the distance is very short, the amplitude of magnetic resonance is oppressed by the strong interaction and thus the MFE can be much lower than that of single MR. This study provides the design rules of metamaterials for engineering resonant properties of MRs.

  10. Interaction of magnetic resonators studied by the magnetic field enhancement

    Directory of Open Access Journals (Sweden)

    Yumin Hou

    2013-12-01

    Full Text Available It is the first time that the magnetic field enhancement (MFE is used to study the interaction of magnetic resonators (MRs, which is more sensitive than previous parameters–shift and damping of resonance frequency. To avoid the coherence of lattice and the effect of Bloch wave, the interaction is simulated between two MRs with same primary phase when the distance is changed in the range of several resonance wavelengths, which is also compared with periodic structure. The calculated MFE oscillating and decaying with distance with the period equal to resonance wavelength directly shows the retardation effect. Simulation also shows that the interaction at normal incidence is sensitive to the phase correlation which is related with retardation effect and is ultra-long-distance interaction when the two MRs are strongly localized. When the distance is very short, the amplitude of magnetic resonance is oppressed by the strong interaction and thus the MFE can be much lower than that of single MR. This study provides the design rules of metamaterials for engineering resonant properties of MRs.

  11. Interaction of magnetic resonators studied by the magnetic field enhancement

    Energy Technology Data Exchange (ETDEWEB)

    Hou, Yumin, E-mail: ymhou@pku.edu.cn [State Key Laboratory for Mesoscopic Physics, School of Physics, Peking University, Beijing 100871 (China)

    2013-12-15

    It is the first time that the magnetic field enhancement (MFE) is used to study the interaction of magnetic resonators (MRs), which is more sensitive than previous parameters–shift and damping of resonance frequency. To avoid the coherence of lattice and the effect of Bloch wave, the interaction is simulated between two MRs with same primary phase when the distance is changed in the range of several resonance wavelengths, which is also compared with periodic structure. The calculated MFE oscillating and decaying with distance with the period equal to resonance wavelength directly shows the retardation effect. Simulation also shows that the interaction at normal incidence is sensitive to the phase correlation which is related with retardation effect and is ultra-long-distance interaction when the two MRs are strongly localized. When the distance is very short, the amplitude of magnetic resonance is oppressed by the strong interaction and thus the MFE can be much lower than that of single MR. This study provides the design rules of metamaterials for engineering resonant properties of MRs.

  12. Magnetic Resonance Imaging Studies of Postpartum Depression: An Overview

    Directory of Open Access Journals (Sweden)

    Marco Fiorelli

    2015-01-01

    Full Text Available Postpartum depression is a frequent and disabling condition whose pathophysiology is still unclear. In recent years, the study of the neural correlates of mental disorders has been increasingly approached using magnetic resonance techniques. In this review we synthesize the results from studies on postpartum depression in the context of structural, functional, and spectroscopic magnetic resonance studies of major depression as a whole. Compared to the relative wealth of data available for major depression, magnetic resonance studies of postpartum depression are limited in number and design. A systematic literature search yielded only eleven studies conducted on about one hundred mothers with postpartum depression overall. Brain magnetic resonance findings in postpartum depression appear to replicate those obtained in major depression, with minor deviations that are not sufficient to delineate a distinct neurobiological profile for this condition, due to the small samples used and the lack of direct comparisons with subjects with major depression. However, it seems reasonable to expect that studies conducted in larger populations, and using a larger variety of brain magnetic resonance techniques than has been done so far, might allow for the identification of neuroimaging signatures for postpartum depression.

  13. Environment sensitive fluorescent analogue of biologically active oxazoles differentially recognizes human serum albumin and bovine serum albumin: Photophysical and molecular modeling studies

    Science.gov (United States)

    Maiti, Jyotirmay; Biswas, Suman; Chaudhuri, Ankur; Chakraborty, Sandipan; Chakraborty, Sibani; Das, Ranjan

    2017-03-01

    An environment sensitive fluorophore, 4-(5-(4-(dimethylamino)phenyl)oxazol-2-yl)benzoic acid (DMOBA), that closely mimics biologically active 2,5-disubstituited oxazoles has been designed to probe two homologous serum proteins, human serum albumin (HSA) and bovine serum albumin (BSA) by means of photophysical and molecular modeling studies. This fluorescent analogue exhibits solvent polarity sensitive fluorescence due to an intramolecular charge transfer in the excited state. In comparison to water, the steady state emission spectra of DMOBA in BSA is characterized by a greater blue shift ( 10 nm) and smaller Stokes' shift ( 5980 cm- 1) in BSA than HSA (Stokes'shift 6600 cm- 1), indicating less polar and more hydrophobic environment of the dye in the former than the latter. The dye-protein binding interactions are remarkably stronger for BSA than HSA which is evident from higher value of the association constant for the DMOBA-BSA complex (Ka 5.2 × 106 M- 1) than the DMOBA-HSA complex (Ka 1.0 × 106 M- 1). Fӧrster resonance energy transfer studies revealed remarkably less efficient energy transfer (8%) between the donor tryptophans in BSA and the acceptor DMOBA dye than that (30%) between the single tryptophan moiety in HSA and the dye, which is consistent with a much larger distance between the donor (tryptophan)-acceptor (dye) pair in BSA (34.5 Å) than HSA (25.4 Å). Site specific competitive binding assays have confirmed on the location of the dye in Sudlow's site II of BSA and in Sudlow's site I of HSA, respectively. Molecular modeling studies have shown that the fluorescent analogue is tightly packed in the binding site of BSA due to strong steric complementarity, where, binding of DMOBA to BSA is primarily dictated by the van der Waals and hydrogen bonding interactions. In contrast, in HSA the steric complementarity is less significant and binding is primarily guided by polar interactions and van der Waals interactions appear to be less significant in the

  14. Aspartame and Its Analogues

    Science.gov (United States)

    Pavlova, L. A.; Komarova, T. V.; Davidovich, Yurii A.; Rogozhin, S. V.

    1981-04-01

    The results of studies on the biochemistry of the sweet taste are briefly reviewed. The methods of synthesis of "aspartame" — a sweet dipeptide — are considered, its structural analogues are described, and quantitative estimates are made of the degree of sweetness relative to sucrose. Attention is concentrated mainly on problems of the relation between the structure of the substance and its taste in the series of aspartyl derivatives. The bibliography includes 118 references.

  15. Cut and paste RNA for nuclear magnetic resonance, paramagnetic resonance enhancement, and electron paramagnetic resonance structural studies.

    Science.gov (United States)

    Duss, Olivier; Diarra Dit Konté, Nana; Allain, Frédéric H-T

    2015-01-01

    RNA is a crucial regulator involved in most molecular processes of life. Understanding its function at the molecular level requires high-resolution structural information. However, the dynamic nature of RNA complicates structure determination because crystallization is often not possible or can result in crystal-packing artifacts resulting in nonnative structures. To study RNA and its complexes in solution, we described an approach in which large multi-domain RNA or protein-RNA complex structures can be determined at high resolution from isolated domains determined by nuclear magnetic resonance (NMR) spectroscopy, and then constructing the entire macromolecular structure using electron paramagnetic resonance (EPR) long-range distance constraints. Every step in this structure determination approach requires different types of isotope or spin-labeled RNAs. Here, we present a simple modular RNA cut and paste approach including protocols to generate (1) small isotopically labeled RNAs (<10 nucleotides) for NMR structural studies, which cannot be obtained by standard protocols, (2) large segmentally isotope and/or spin-labeled RNAs for diamagnetic NMR and paramagnetic relaxation enhancement NMR, and (3) large spin-labeled RNAs for pulse EPR spectroscopy.

  16. Cobalamin analogues in humans: a study on maternal and cord blood.

    Directory of Open Access Journals (Sweden)

    Tore Forsingdal Hardlei

    Full Text Available BACKGROUND: Haptocorrin (HC carries cobalamin analogues (CorA, but whether CorA are produced in the body is unknown. All cobalamins (Cbl to the foetus are delivered by the Cbl-specific protein transcobalamin (TC, and therefore analysis of cord serum for CorA may help to clarify the origin of CorA. METHODS: HC-CorA were quantified in paired samples of cord serum from newborns and serum from mothers (n = 69. RESULTS: The CorA-concentration was higher in cord serum (median = 380, range: 41-780 pmol/L than in serum from the mothers (median = 160, range: 64-330 pmol/L, (p<0.0001. HPLC-analysis showed CorA-peaks with retention times of 13.5, 14,5 and 16.5 min in samples from both the mother and cord serum. The peak with retention time 16.5 min constituted 24% (mother and 45% (cord serum of the total amount CorA, and eluted as does dicyanocobinamide. CONCLUSION: Our results support that CorA in the human body are derived from Cbl.

  17. Theoretical Study of the Photophysics of 8-Vinylguanine, an Isomorphic Fluorescent Analogue of Guanine.

    Science.gov (United States)

    Kochman, Michał A; Pola, Martina; Miller, R J Dwayne

    2016-08-11

    Paving the way for the application of the algebraic-diagrammatic construction scheme of second-order (ADC(2)) to systems based on the guanine chromophore, we demonstrate the this excited-state electronic structure method provides a realistic description of the photochemistry of 9H-guanine, in close agreement with the benchmark provided by the CASPT2 method. We then proceed to apply the ADC(2) method to the photochemistry of 8-vinylguanine (8vG), a minimally modified analogue of guanine which, unlike the naturally occurring nucleobase, displays intense fluorescence, indicative of a much longer-lived excited electronic state. The emissive electronic state of 8vG is identified as an ππ*-type intramolecular charge transfer (ICT) state, in which a charge of roughly -0.2 e is transferred from the guanine moiety onto the vinyl substituent. The main radiationless deactivation pathway competing with fluorescence is predicted to involve the molecule leaving the minimum on the ICT ππ* state, and reaching a region of the S1 adiabatic state where it resembles the La ππ* state of unmodified 9H-guanine. The topology of the La ππ* region of the S1 state favors subsequent internal conversion at a crossing seam with the ground electronic state. The sensitivity of this process to environment polarity may explain the experimentally observed fluorescence quenching of 8vG upon incorporation in single- and double-stranded DNA.

  18. Structure-activity study on the Phe side chain arrangement of endomorphins using conformationally constrained analogues.

    Science.gov (United States)

    Tömböly, Csaba; Kövér, Katalin E; Péter, Antal; Tourwé, Dirk; Biyashev, Dauren; Benyhe, Sándor; Borsodi, Anna; Al-Khrasani, Mahmoud; Rónai, András Z; Tóth, Géza

    2004-01-29

    Endomorphins-1 and -2 were substituted with all the beta-MePhe stereoisomers in their Phe residues to generate a conformationally constrained peptide set. This series of molecules was subjected to biological assays, and for beta-MePhe(4)-endomorphins-2, a conformational analysis was performed. Incorporation of (2S,3S)-beta-MePhe(4) resulted in the most potent analogues of both endomorphins with enhanced enzymatic stability. Their micro opioid affinities were 4-times higher than the parent peptides, they stimulated [(35)S]GTPgammaS binding, and they were found to be full agonists. NMR experiments revealed that C-terminal (2S,3S)-beta-MePhe in endomorphin-2 strongly favored the gauche (-) spatial orientation which implies the presence of the chi(1) = -60 degrees rotamer of Phe(4) in the binding conformer of endomorphins. Our results emphasize that the appropriate orientation of the C-terminal aromatic side chain of endomorphins is substantial for binding to the micro opioid receptor.

  19. Study the interactions between human serum albumin and two antifungal drugs: fluconazole and its analogue DTP.

    Science.gov (United States)

    Zhang, Shao-Lin; Yao, Huankai; Wang, Chenyin; Tam, Kin Y

    2014-11-01

    Binding affinities of fluconazole and its analogue 2-(2,4-dichlorophenyl)-1,3-di(1H-1,2,4-triazol-yl)-2-propanol (DTP) to human serum albumin (HSA) were investigated under approximately human physiological conditions. The obtained result indicated that HSA could generate fluorescent quenching by fluconazole and DTP because of the formation of non-fluorescent ground-state complexes. Binding parameters calculated from the Stern-Volmer and the Scatchard equations showed that fluconazole and DTP bind to HSA with binding affinities of the order 10(4)L/mol. The thermodynamic parameters revealed that the binding was characterized by negative enthalpy and positive entropy changes, suggesting that the binding reaction was exothermic. Hydrogen bonds and hydrophobic interaction were found to be the predominant intermolecular forces stabilizing the drug-protein. The effect of metal ions on the binding constants of fluconazole-HSA complex suggested that the presence of Mg(2+) and Zn(2+) ions could decrease the free drug level and extend the half-life in the systematic circulation. Docking experiments revealed that fluconazole and DTP binds in HSA mainly by hydrophobic interaction with the possibility of hydrogen bonds formation between the drugs and the residues Arg 222, Lys 199 and Lys 195 in HSA.

  20. Studying the $\\rho$ resonance parameters with staggered fermions

    CERN Document Server

    Fu, Ziwen

    2016-01-01

    We deliver a lattice study of $\\rho$ resonance parameters with p-wave $\\pi\\pi$ scattering phases, which are extracted by finite-size methods at one center-of-mass frame and four moving frames for six MILC lattice ensembles with pion masses ranging from $346$ to $ 176$ MeV. The effective range formula is applied to describe the scattering phases as a function of the energy covering the resonance region, this allows us to extract $\\rho$ resonance parameters and to investigate the quark-mass dependence. Lattice studies with three flavors of the Asqtad-improved staggered fermions enable us to use the moving-wall source technique on large lattice spatial dimensions ($L=64$) and small light $u/d$ quarks. Numerical computations are carried out at two lattice spacings, $a \\approx 0.12$ and $0.09$ fm.

  1. Studying the ρ resonance parameters with staggered fermions

    Science.gov (United States)

    Fu, Ziwen; Wang, Lingyun

    2016-08-01

    We deliver a lattice study of ρ resonance parameters with p -wave π π scattering phases, which are extracted by finite-size methods at one center-of-mass frame and four moving frames for six lattice ensembles from the MILC Collaboration with pion masses ranging from 346 to 176 MeV. The effective range formula is applied to describe the scattering phases as a function of the energy covering the resonance region; this allows us to extract ρ resonance parameters and to investigate the quark-mass dependence. Lattice studies with three flavors of Asqtad-improved staggered fermions enable us to use the moving-wall source technique on large lattice spatial dimensions (L =64 ) and small light u /d quarks. Numerical computations are carried out at two lattice spacings, a ≈0.12 and 0.09 fm.

  2. Magnetic resonance studies of solid polymers; Etude des polymeres solides par resonance magnetique

    Energy Technology Data Exchange (ETDEWEB)

    Lenk, R. [Commissariat a l' Energie Atomique, Grenoble (France). Centre d' Etudes Nucleaires

    1969-07-01

    This paper is a review of the application of nuclear magnetic resonance (NMR) to solid polymers. In the first, theoretical part, the elements of the theory of NMR, which are necessary for the study of the properties of solid polymers are discussed: the moments method, nuclear relaxation and the distribution of correlation times. In the second part the experimental results are presented. (author) [French] Cette etude est une recherche bibliographique sur l'application de la resonance magnetique nucleaire (RMN) aux polymeres solides. Dans la premiere partie theorique on discute les elements de la theorie de RMN, necessaires pour l'etude des proprietes des polymeres solides: la methode des moments, la relaxation nucleaire et la distribution des temps de correlation. La deuxieme partie presente les resultats des experiences. (auteur)

  3. EPR study of thermally treated Archean microbial mats analogues and comparison with Archean cherts: towards a possible marker of oxygenic photosynthesis?

    Science.gov (United States)

    Bourbin, M.; Derenne, S.; Westall, F.; Gourier, D.; Gautret, P.; Rouzaud, J.-N.; Robert, F.

    2012-04-01

    The datation of photosynthesis apparition remains an open question nowadays: did oxygenic photosynthesis appear just before the Great Oxidation Event (GOE) of the atmosphere, 2.3 to 2.4 Gyr ago, or does it originate much earlier? It is therefore of uttermost interest to find markers of oxygenic photosynthesis, applicable to samples of archean age. In order to handle this problem, Microcoleus Chtonoplastes cyanobacteria and Chloroflexus-like non-oxygenic photosynthetic bacteria, were studied using Electron Paramagnetic Resonance (EPR) spectroscopy, a high sensitivity technique for the study of organic radicals in mature geological samples (coals, cherts, meteorites...). M. chtonoplastes and Chloroflexus-like bacteria were sampled in mats from the hypersaline lake "La Salada de Chiprana" (Spain), an analogue to an Archean environment, and were submitted to accelerated ageing through cumulative thermal treatments. For thermal treatment temperatures higher than 620° C, a drastic increase in the EPR linewidth of the oxygenic photosynthetic bacteria (M. chtonoplastes) occurred, as compared with the anoxygenic photosynthetic one (Chloroflexus-like). The EPR study of a thermally treated mixture of the two bacteria evidences that this linewidth increase is driven by catalytic reaction at high temperatures on an element selectively fixed by M. chtonoplastes. Based on comparative EDS analyses, Mg is a potential candidate for this catalytic activity but its precise role and the nature of the reaction are still to be determined. The EPR study of organic radicals in chert rocks of ages ranging from 0.42 to 3.5 Gyr, from various localities and that underwent various metamorphisms, revealed a dispersion of the signal width for the most mature samples. This comparative approach between modern bacterial samples and Precambrian cherts leads to propose the EPR linewidth of mature organic matter in cherts as a potential marker of oxygenic photosynthesis. If confirmed, this marker

  4. cis-Nitenpyram Analogues Bearing Acyloxy Segments Anchored on the Tetrahydropyrimidine Ring: Synthesis,Insecticidal Activities and Molecular Docking Studies

    Institute of Scientific and Technical Information of China (English)

    SUN Chuan-wen; WU Ying; CHEN Yan-xia; NAN Shi-bin; ZHANG Wang-geng

    2013-01-01

    A series of novel cis-nitenpyram analogues bearing acyloxy segments anchored on the tetrahydropyrimidine ring was designed and synthesized.Preliminary bioassays indicate that all the nitenpyram analogues 3a—3n exhibit good insecticidal activities against Nilaparvata lugens and Aphis medicaginis at 100 mg/L,while analogue 3k affords the best activity in vitro and the lethal concentration 50(LC50) values(0.187,0.214 mg/L) are close to that of nitenpyram.The structure activity relationships(SARs) suggest that their insecticidal potency is influenced by the species of acyloxy segments.The docking results reveal that analogue 3k forms stronger hydrogen-bonding with the nAChR,which explain the structure activity relationships(SARs) observed in vitro and imply that the strategies of our designed nitenpyram analogues are feasible.

  5. Analogue computing methods

    CERN Document Server

    Welbourne, D

    1965-01-01

    Analogue Computing Methods presents the field of analogue computation and simulation in a compact and convenient form, providing an outline of models and analogues that have been produced to solve physical problems for the engineer and how to use and program the electronic analogue computer. This book consists of six chapters. The first chapter provides an introduction to analogue computation and discusses certain mathematical techniques. The electronic equipment of an analogue computer is covered in Chapter 2, while its use to solve simple problems, including the method of scaling is elaborat

  6. 3D-QSAR Studies on a Series of Dihydroorotate Dehydrogenase Inhibitors: Analogues of the Active Metabolite of Leflunomide

    Directory of Open Access Journals (Sweden)

    Hong-Guang Du

    2011-05-01

    Full Text Available The active metabolite of the novel immunosuppressive agent leflunomide has been shown to inhibit the enzyme dihydroorotate dehydrogenase (DHODH. This enzyme catalyzes the fourth step in de novo pyrimidine biosynthesis. Self-organizing molecular field analysis (SOMFA, a simple three-dimensional quantitative structure-activity relationship (3D-QSAR method is used to study the correlation between the molecular properties and the biological activities of a series of analogues of the active metabolite. The statistical results, cross-validated rCV2 (0.664 and non cross-validated r2 (0.687, show a good predictive ability. The final SOMFA model provides a better understanding of DHODH inhibitor-enzyme interactions, and may be useful for further modification and improvement of inhibitors of this important enzyme.

  7. Magnetic Resonance Perfusion Imaging in the Study of Language

    Science.gov (United States)

    Hillis, Argye E.

    2007-01-01

    This paper provides a brief review of various uses of magnetic resonance perfusion imaging in the investigation of brain/language relationships. The reviewed studies illustrate how perfusion imaging can reveal areas of brain where dysfunction due to low blood flow is associated with specific language deficits, and where restoration of blood flow…

  8. Alligator Rivers Analogue project. Hydrogeological field studies. Final Report - Volume 5

    Energy Technology Data Exchange (ETDEWEB)

    Davis, S.N. [Univ of Arizona, Tucson, Arizona (United States). Dept of Hydrology and Water Resources; Marley, R.D. [D.B. Stephens and Associates Inc., Albuquerque, NM (United States); Norris, J.R. [Hydro Geo Chem Inc., Tucson, Arizona (United States)

    1992-12-31

    The hydrogeology of the Koongarra site was interpreted primarily from long-term hydrographs, water-level maps, water injection tests, aquifer pumping tests, logs of boreholes, and chemical analyses of groundwater samples. Data have been collected over a 21-year period starting with test-drilling in 1970. The first intensive period of hydrogeologic investigations was from 1978 through 1981 and was related to anticipated exploitation of uranium ore at Koongarra. The second period was from 1986 through 1991 and was related to the international Alligator Rivers Analogue Project under the direction of the Australian Nuclear Science and Technology Organisation. The conclusion which can be drawn from the chemical data is that water moving out of the No. 1 ore deposit is diluted rapidly with recharge from the surface as it migrates down the hydraulic gradient. Most of the groundwater outside of the ore deposit does not originate from the ore deposit, and flow models which assume unmodified stream tubes extending out of the ore deposit in a downgradient direction do not reflect the true system. Water in the ore deposit itself, must come from slow upward seepage through the fault zone. Owing to the fact that this water must be at least hundreds of years old, observed fluctuations of water levels in the deposit must reflect pressure head variations induced by seasonal recharge to the overlying surficial materials. Water level fluctuations do not signify a yearly displacement of water deep in the system. Water in the deeper part of the ore must be almost static compared to obvious rapid groundwater circulation in the area around PH88. Small changes in pH, temperature and specific electrical conductivity during aquifer tests indicate a complex hydraulic system which has a variable response to pumping as a function of time. Low concentration in tritium and Carbon-14 together with high concentrations of dissolved helium in the groundwaters all suggested strongly that semi static

  9. Fabrication of a Resonant Photoacoustic Cell for Samples Study

    Directory of Open Access Journals (Sweden)

    J.C. Kapil

    2004-04-01

    Full Text Available Nondestructive treatment of a sample in photoacoustic spectroscopy is helpful in the study of thermal and optical properties of ice and snow. In the present study, a  low-temperature resonant photoacoustic cell, based on Helmholtz resonator model, has been designed and fabricated for the study of samples like ice or snow. Its performance has also been studied using carbon black as a standard sample and various other samples like water, ice, glass, plexi-glass, polycarbonate, etc. Thermal diffusivity of ice, water, and many other transparent materials has been determined by varying chopping frequency and recording corresponding phase changes in the photoacoustic signal. The results obtained are in good agreement with those predicted by Rosencwaig-Gersho (R-G' theory.

  10. 3-Dimensional QSAR and molecular docking studies of a series of indole analogues as inhibitors of human non-pancreatic secretory phospholipase A2

    Directory of Open Access Journals (Sweden)

    Kulwinder Singh

    2014-06-01

    Conclusion: The present study shall help in rational drug design and synthesis of new selective PLA2 inhibitors with predetermined affinity and activity and provides valuable information for the understanding of interactions between PLA2 and the novel indole analogue compounds. [Int J Res Med Sci 2014; 2(3.000: 995-1002

  11. Nitenpyram analogues with 1,4-dihydropyridine fixed cis-configuration:synthesis,insecticidal activities and molecular docking studies

    Directory of Open Access Journals (Sweden)

    XUE Sijia

    2013-08-01

    Full Text Available A novel series of Nitenpyram analogues(Ia-Ij with 1,4-dihydropyridine fixed cis-configuration were designed and synthesized.Preliminary bioassays showed that most of them exhibited good insecticidal activities against Aphis medicagini and Brown rice planthopper at 500 mg/L and 100 mg/L.The analogue Ij afforded the best activity in vitro,that had 100% mortality at 4 mg/L against Brown rice planthopper and Aphis medicagin.In addition,the molecular docking simulations revealed that the structural uniqueness of these analogues may lead to a unique molecular recognition and binding mode,and the results explained the SARs observed in vitro, which shed light on the novel insecticidal mechanism of these novel nitenpyam analogues.

  12. Resonators

    NARCIS (Netherlands)

    Wijnant, Y.H.

    2006-01-01

    For quite a few number of years now, the Structural Dynamics and Acoustics group at the University of Twente studies wave propagation in narrow gaps (e.g. thermal-viscous wave propagation in narrow tubes and thin air layers). The waves propagating in these narrow gaps can be described elegantly by m

  13. Development of bacteriorhodopsin analogues and studies of charge separated excited states in the photoprocesses of linear polyenes.

    Science.gov (United States)

    Singh, Anil K; Hota, Prasanta K

    2007-01-01

    Development of bacteriorhodopsin (bR) analogues employing chromophore substitution technique for the purpose of characterizing the binding site of bR and generating bR analogues with novel opto-electronic properties for applications as photoactive element in nanotechnical devices are described. Additionally, the photophysical and photochemical properties of variously substituted diarylpolyenes as models of photobiologically relevant linear polyenes are discussed. The role of charge separated dipolar excited states in the photoprocesses of linear polyenes is highlighted.

  14. Resonance Raman Scattering Studies of Gallium - - Aluminum-Arsenide Superlattices.

    Science.gov (United States)

    Gant, Thomas Andrew

    We have made resonance Raman scattering studies of folded LA phonons and quantized LO phonons in several GaAs-AlAs superlattices. The motivation for this work was to study the electronic structure and the electron -phonon interaction in these structures. The samples were not intentionally doped. The Raman spectra of optic phonons were usually taken at a temperature of 10 K or less. The folded acoustic phonon work was taken at temperatures ranging from 200-300 K in order to enhance the scattering by the thermal factor. Two samples in particular have received very close attention: sample 2292 (50 A GaAs- 20 A AlAs) and sample 3250 (20 A GaAs- 50 A AlAs). In sample 2292 we have made resonance studies of the folded LA phonons and the GaAs -like confined LO_2 mode near the second heavy hole exciton. The results on the folded acoustic phonons show a very strong resonance enhancement for the second order folded phonons, but very little for the first order. An interference between two different scattering channels (the n = 1 light hole and the n = 2 heavy hole subbands) seems to be responsible for this effect. The resonance profile for the LO_2 confined optic phonon in sample 2292 shows 4 peaks in the region from 1.8 eV to 2.05 eV. We have studied the dependence of this resonance profile on the power density. A higher power density was achieved by using the same laser power with a tighter focus. At the higher power density the peak at 1.93 eV (formerly the strongest peak present) vanished. This "bleaching" effect is related to screening due to the higher carrier density. In sample 3250 we have studied the polarization dependence of the resonance profiles of four peaks (LO _2, LO_4, LO_6, and an interface mode) near the lowest direct gap. The A_1 symmetry confined LO modes are seen in both polarized and depolarized geometries, in violation of the usual selection rule (polarized). A mechanism is proposed to explain this result, which has been previously observed by other

  15. Analogue MIMO Detection

    Directory of Open Access Journals (Sweden)

    McNamara Darren

    2006-01-01

    Full Text Available In this contribution we propose an analogue receiver that can perform turbo detection in MIMO systems. We present the case for a receiver that is built from nonlinear analogue devices, which perform detection in a "free-flow" network (no notion of iterations. This contribution can be viewed as an extension of analogue turbo decoder concepts to include MIMO detection. These first analogue implementations report reductions of few orders of magnitude in the number of required transistors and in consumed energy, and the same order of improvement in processing speed. It is anticipated that such analogue MIMO decoder could bring about the same advantages, when compared to traditional digital implementations.

  16. Comparative Study of Modern Stromatolites in Coastal Lagoa Salgada and Lagoa Vermehla, Brazil: Analogues for Precambrian Environmental Evolution

    Science.gov (United States)

    Vasconcelos, C.; Lundberg, R.; Bahniuk, A.; Och, L.; McKenzie, J. A.

    2009-12-01

    Ancient microbial processes continue to be active in isolated modern lacustrine environments. As these unique environments can serve as analogues for Precambrian systems, biogeochemical studies in modern lakes or lagoons can be used to develop a better understanding of microcosms thriving on the early Earth. We study the biogeochemical processes associated with modern stromatolite formation in two distinctly different lagoons (lagoas in Portuguese) located in a special semi-arid microclimate within the tropical region along the central Brazilian coast. Although the stromatolites in both lagoons are characterized by high-Mg calcite to dolomite precipitation, the aqueous geochemistry is very different. Lagoa Salgada, Brazil contains fresh to brackish water feed by meteoric ground waters and has low sulfate concentrations, whereas Lagoa Vermehla, Brazil is brackish to hypersaline as a result of recharge with altered marine water and has sulfate concentrations greater than normal sea water. The average oxygen isotope composition of the in situ stromatolites reflects the different hydrology of the lakes: δ18O values of Lagoa Salgada stromatolites average -1.5 ‰, while the δ18O values of Lagoa Vermehla stromatolites average 1.5 ‰. Furthermore, the average carbon isotope composition of the stromatolites mirrors the prominent microbial process active in the lakes: δ13C values of Lagoa Salgada stromatolites average 10 to 20 ‰, while the δ13C values of Lagoa Vermehla stromatolites average -2.5 ‰. These dissimilar δ13C values indicate the importance of different microbial processes as the main carbon source for the carbonate incorporated into the laminae, that is, methanogenesis vs. sulfate reduction, respectively. In fact, using microbiologic and genomic techniques, the molecular characterization of the microbial mats from which the discrete laminae develop is consistent with this geochemical observation. We propose that a comparative study of the Lagoa Salgada

  17. Anesthesia and critical-care delivery in weightlessness: A challenge for research in parabolic flight analogue space surgery studies

    Science.gov (United States)

    Ball, Chad G.; Keaney, Marilyn A.; Chun, Rosaleen; Groleau, Michelle; Tyssen, Michelle; Keyte, Jennifer; Broderick, Timothy J.; Kirkpatrick, Andrew W.

    2010-03-01

    BackgroundMultiple nations are actively pursuing manned exploration of space beyond low-earth orbit. The responsibility to improve surgical care for spaceflight is substantial. Although the use of parabolic flight as a terrestrial analogue to study surgery in weightlessness (0 g) is well described, minimal data is available to guide the appropriate delivery of anesthesia. After studying anesthetized pigs in a 0 g parabolic flight environment, our group developed a comprehensive protocol describing prolonged anesthesia in a parabolic flight analogue space surgery study (PFASSS). Novel challenges included a physically remote vivarium, prolonged (>10 h) anesthetic requirements, and the provision of veterinary operating room/intensive care unit (ICU) equivalency on-board an aircraft with physical dimensions of ethical approval, multiple ground laboratory sessions were conducted with combinations of anesthetic, pre-medication, and induction protocols on Yorkshire-cross specific pathogen-free (SPF) pigs. Several constant rate infusion (CRI) intravenous anesthetic combinations were tested. In each regimen, opioids were administered to ensure analgesia. Ventilation was supported mechanically with blended gradients of oxygen. The best performing terrestrial 1 g regime was flight tested in parabolic flight for its effectiveness in sustaining optimal and prolonged anesthesia, analgesia, and maintaining hemodynamic stability. Each flight day, a fully anesthetized, ventilated, and surgically instrumented pig was transported to the Flight Research Laboratory (FRL) in a temperature-controlled animal ambulance. A modular on-board surgical/ICU suite with appropriate anesthesia/ICU and surgical support capabilities was employed. ResultsThe mean duration of anesthesia (per flight day) was 10.28 h over four consecutive days. A barbiturate and ketamine-based CRI anesthetic regimen supplemented with narcotic analgesia by bolus administration offered the greatest prolonged hemodynamic

  18. Study of metalloproteins using continuous wave electron paramagnetic resonance (EPR).

    Science.gov (United States)

    Gambarelli, Serge; Maurel, Vincent

    2014-01-01

    Electron paramagnetic resonance (EPR) is an invaluable tool when studying systems with paramagnetic centers. It is a sensitive spectroscopic method, which can be used with dilute samples in aqueous buffer solutions. Here, we describe the basic procedure for recording an X-band EPR spectrum of a metalloprotein sample at low temperature. We also discuss basic optimization techniques to provide spectra with a high signal to noise ratio and minimum distortion.

  19. 27Al nuclear quadrupole resonance study of crystalline aluminosilicates

    Science.gov (United States)

    Lee, Donghoon; Bray, P. J.

    27Al NQR responses have been obtained from the three different forms of crystalline Al 2SiO 5, andalusite, kyanite, and sillimanite, by a very sensitive Robinson-type continuous wave NQR spectrometer at 77 K or at room temperature. From the NQR responses the values of Qcc and of η were determined for all the aluminum coordinations in the powdered samples. The values are compared with those obtained by nuclear magnetic resonance studies of single crystals.

  20. Experimental study of resonance fiber optic gyroscope employing a dual-ring resonator

    Science.gov (United States)

    Fan, Yue; Wang, Wei

    2016-09-01

    A dual-ring resonator which is available to alter the full width at half maximum (FWHM) without altering the free spectrum range (FSR) for practice applications is analyzed theoretically and set up in practice. The parameters of the dual-ring resonator have been optimized in simulation, the resonance depth and the dynamic range are enhanced. The prototype is set up with single mode fiber of 8 meter and two 95 : 5 couplers for open loop experiment. The FWHM of the dual-ring resonator is demonstrated less than 1.5MHz and the fineness is calculated to be 37 during the frequency sweeping experiment. The frequency locking experiment with demodulation curve method has been accomplished, and the locking time achieves less than 40ms. All these provide a basic reference for optimizing the resonance fiber optic gyro based on dual-ring resonator.

  1. Basic investigation and analysis for preferred host rocks and natural analogue study area with reference to high level radioactive waste disposal

    Energy Technology Data Exchange (ETDEWEB)

    Seo, Jeong Ryul; Park, J. K.; Hwang, D. H.; Lee, J. H.; Yun, H. S.; Kim, D. Y.; Park, H. S.; Koo, S. B.; Cho, J. D.; Kim, K. E. [Korea Inst. of Geology, Mining and Materials, Taejon (Korea, Republic of)

    1997-12-01

    The purpose of this study is basic investigation and analysis for preferred host rocks and natural analogue study area to develope underground disposal technique of high level radioactive waste in future. The study has been done for the crystalline rocks(especially granitic rocks) with emphasis of abandoned metallic mines and uranium ore deposits, and for the geological structure study by using gravity and aeromagnetic data. 138 refs., 54 tabs., 130 figs. (author)

  2. Asymmetric Synthesis and Binding Study of New Long-Chain HPA-12 Analogues as Potent Ligands of the Ceramide Transfer Protein CERT.

    Science.gov (United States)

    Ďuriš, Andrej; Daïch, Adam; Santos, Cécile; Fleury, Laurence; Ausseil, Frédéric; Rodriguez, Frédéric; Ballereau, Stéphanie; Génisson, Yves; Berkeš, Dušan

    2016-05-01

    A series of 12 analogues of the Cer transfer protein (CERT) antagonist HPA-12 with long aliphatic chains were prepared as their (1R,3S)-syn and (1R,3R)-anti stereoisomers from pivotal chiral oxoamino acids. The enantioselective access to these intermediates as well as their ensuing transformation relied on a practical crystallization-induced asymmetric transformation (CIAT) process. Sonogashira coupling followed by triple bond reduction and thiophene ring hydrodesulfurization (HDS) into the corresponding alkane moieties was then implemented to complete the synthetic routes delivering the targeted HPA-12 analogues in concise 4- to 6-step reaction sequences. Ten compounds were evaluated regarding their ability to bind to the CERT START domain by using the recently developed time-resolved FRET-based homogeneous (HTR-FRET) binding assay. The introduction of a lipophilic appendage on the phenyl moiety led to an overall 10- to 1000-fold enhancement of the protein binding, with the highest effect being observed for a n-hexyl residue in the meta position. The importance of the phenyl ring for the activity was indicated by the reduced potency of the 3-deoxyphytoceramide aliphatic analogues. The 1,3-syn stereoisomers were systematically more potent than their 1,3-anti analogues. In silico studies were used to rationalized these trends, leading to a model of protein recognition coherent with the stronger binding of (1R,3S)-syn HPAs.

  3. Scissors Mode of 162Dy Studied from Resonance Neutron Capture

    Directory of Open Access Journals (Sweden)

    Baramsai B.

    2015-01-01

    Full Text Available Multi-step cascade γ-ray spectra from the neutron capture at isolated resonances of 161Dy nucleus were measured at the LANSCE/DANCE time-of-flight facility in Los Alamos National Laboratory. The objectives of this experiment were to confirm and possibly extend the spin assignment of s-wave neutron resonances and get new information on photon strength functions with emphasis on the role of the M1 scissors mode vibration. The preliminary results show that the scissors mode plays a significant role in all transitions between accessible states of the studied nucleus. The photon strength functions describing well our data are compared to results from 3He-induced reactions, (n,γ experiments on Gd isotopes, and (γ,γ’ reactions.

  4. Scissors mode of Gd nuclei studied from resonance neutron capture

    Science.gov (United States)

    Kroll, J.; Baramsai, B.; Becker, J. A.; Bečvár, F.; Bredeweg, T. A.; Couture, A.; Chyzh, A.; Dashdorj, D.; Haight, R. C.; Heil, M.; Jandel, M.; Käppeler, F.; Krtička, M.; Mitchell, G. E.; O'Donnell, J. M.; Parker, W.; Reifarth, R.; Rundberg, R. S.; Ullmann, J. L.; Valenta, S.; Vieira, D. J.; Walker, C. L.; Wilhelmy, J. B.; Wouters, J. M.; Wu, C. Y.

    2012-10-01

    Spectra of γ rays following the neutron capture at isolated resonances of stable Gd nuclei weremeasured. The objectives were to get new information on photon strength of 153,155-159Gd with emphasis on the role of the M1 scissors-mode vibration. An analysis of the data obtained clearly indicates that the scissors mode is coupled not only to the ground state, but also to all excited levels of the nuclei studied. The specificity of our approach ensures unbiasedness in estimating the sumed scissors-mode strength ΣB(M1)↑, even for odd product nuclei, for which conventional nuclear resonance fluorescence measurements yield only limited information. Our analysis indicates that for these nuclei the sum ΣB(M1)↑ increases with A and for 157,159Gd it is significantly higher compared to 156,158Gd.

  5. Scissors Mode of 162Dy Studied from Resonance Neutron Capture

    Science.gov (United States)

    Baramsai, B.; Bečvář, F.; Bredeweg, T. A.; Haight, R. C.; Jandel, M.; Kroll, J.; Krtička, M.; Mitchell, G. E.; O'Donnell, J. M.; Rundberg, R. S.; Ullmann, J. L.; Valenta, S.; Wilhelmy, J. B.

    2015-05-01

    Multi-step cascade γ-ray spectra from the neutron capture at isolated resonances of 161Dy nucleus were measured at the LANSCE/DANCE time-of-flight facility in Los Alamos National Laboratory. The objectives of this experiment were to confirm and possibly extend the spin assignment of s-wave neutron resonances and get new information on photon strength functions with emphasis on the role of the M1 scissors mode vibration. The preliminary results show that the scissors mode plays a significant role in all transitions between accessible states of the studied nucleus. The photon strength functions describing well our data are compared to results from 3He-induced reactions, (n,γ) experiments on Gd isotopes, and (γ,γ') reactions.

  6. Cyclotron resonance studies on InAs/GaSb heterostructures

    CERN Document Server

    Petchsingh, C

    2002-01-01

    Far-infrared cyclotron resonance is used to study the magneto-optical properties of semimetallic InAs/GaSb heterostructures. Spatially separated two-dimensional electron and hole gases coexist in this 'broken-gap' type-ll system due to charge transfer across the interfaces. Hybridisations of the overlapping electron and hole wavefunctions are investigated experimentally in samples of varying growth parameters. A self-consistent 8-band k centre dot p model is used to assist in the interpretation of experimental results. In samples subjected to varying magnetic field, hybridisations result in oscillations of cyclotron resonance mass, amplitude and linewidth, accompanied by transition splittings in the vicinity of Landau level anticrossings. Asymmetries introduced by InSb interface biasing enhance these effects. Comparison of samples with varying confinement energies (at specified magnetic field) shows effective mass enhancement greater than the standard nonparabolicity effect. The mass enhancement increases wit...

  7. Familial Essential Tremor Studied With Functional Magnetic Resonance Imaging

    Science.gov (United States)

    Hernandez, A.; Salgado, P.; Gil, A.; Barrios, F. A.

    2003-09-01

    Functional Magnetic Resonance Imaging has become an important analytical tool to study neurodegenerative diseases. We applied the EPI-BOLD functional Magnetic Resonance Imaging technique to acquire functional images of patients with familial essential tremor (FET) disorder and healthy control volunteers, during a motor task activity. Functional and anatomic images were used to produce the brain activation maps of the patients and volunteers. These functional maps of the primary somatosensorial and motor cortexes of patients and control subjects were compared for functional differences per subject. The averaged functional brain images of eight of each case were acquired were, it can be clearly observed the differences in active zones. The results presented in this work show that there are differences in the functional maps during motor task activation between control subjects and FET patients suggesting a cerebral functional reorganization that can be mapped with BOLD-fMRI.

  8. Hydrogen atom abstraction of 3,5-disubstituted analogues of paracetamol by horseradish peroxidase and cytochrome P450

    NARCIS (Netherlands)

    Bessems, J.G.M.; Groot, M.J. de; Baede, E.J.; Koppele, J.M. te; Vermeulen, N.P.E.

    1998-01-01

    1. The formation of free radicals during enzyme catalysed oxidation of eight 3,5-disubstituted analogues of paracetamol (PAR) has been studied. A simple peroxidase system as well as cytochrome P450-containing systems were used. Radicals were detected by electron spin resonance (ESR) on incubation of

  9. Astrobiology through the ages of Mars: the study of terrestrial analogues to understand the habitability of Mars.

    Science.gov (United States)

    Fairén, Alberto G; Davila, Alfonso F; Lim, Darlene; Bramall, Nathan; Bonaccorsi, Rosalba; Zavaleta, Jhony; Uceda, Esther R; Stoker, Carol; Wierzchos, Jacek; Dohm, James M; Amils, Ricardo; Andersen, Dale; McKay, Christopher P

    2010-10-01

    Mars has undergone three main climatic stages throughout its geological history, beginning with a water-rich epoch, followed by a cold and semi-arid era, and transitioning into present-day arid and very cold desert conditions. These global climatic eras also represent three different stages of planetary habitability: an early, potentially habitable stage when the basic requisites for life as we know it were present (liquid water and energy); an intermediate extreme stage, when liquid solutions became scarce or very challenging for life; and the most recent stage during which conditions on the surface have been largely uninhabitable, except perhaps in some isolated niches. Our understanding of the evolution of Mars is now sufficient to assign specific terrestrial environments to each of these periods. Through the study of Mars terrestrial analogues, we have assessed and constrained the habitability conditions for each of these stages, the geochemistry of the surface, and the likelihood for the preservation of organic and inorganic biosignatures. The study of these analog environments provides important information to better understand past and current mission results as well as to support the design and selection of instruments and the planning for future exploratory missions to Mars.

  10. A comparative study of aesthetic perceptions of malocclusion among general practice dentists, orthodontists and the public using a visual analogue scale (VAS) and the IOTN-AC

    Science.gov (United States)

    Julián-Castellote, Gonzalo; Montiel-Company, José-María; Almerich-Silla, José-Manuel; Bellot-Arcís, Carlos

    2016-01-01

    Background Perception of malocclusion varies among individuals and among patients and practitioners. Although several indices that tend to coincide in many aspects and unify criteria, no single index has been recognised as the most suitable for assessing orthodontic treatment need. Moreover, orthodontists are not always aware of the differences in perception of malocclusion between patients and practitioners. Objetives To examine the perception of dental anaesthetics amongst dentists, orthodontists and the general population, study the relationship between the perception of dental aesthetics and the severity of the malocclusion, using the visual analogue scale and the IOTN-AC, and investigate relationships among the resulting data. Study Design Frontal intraoral photographs of 24 cases were classified by the severity of their malocclusion according to the DAI index. The photographs were examined by 150 individuals (30 orthodontists, 30 general dental practitioners and 90 members of the general population), who assessed them on a visual analogue scale and according to the IOTN-AC. Results The orthodontists gave the lowest scores on the visual analogue scale, although the differences between the three groups were not significant. For DAI grades 1, 3 and 4, significant differences were found in the IOTN-AC assessments. Here too, the orthodontist group was the most critical. Conclusions In general, in all three groups, both the visual analogue scale and IOTN-AC scores increased or decreased in line with the severity of the malocclusion according to the DAI. However, the correlation between these scores was low. The orthodontists scored the malocclusions more critically than the general dentists or the general population with the IOTN-AC, but this difference was not found with the visual analogue scale. Key words:IOTN-AC, DAI, malocclusion. PMID:27957275

  11. Geothermal energy from the Main Karoo Basin (South Africa): An outcrop analogue study of Permian sandstone reservoir formations

    Science.gov (United States)

    Campbell, Stuart A.; Lenhardt, Nils; Dippenaar, Matthys A.; Götz, Annette E.

    2016-04-01

    The geothermal potential of the South African Main Karoo Basin has not been addressed in the past, although thick siliciclastic successions in geothermal prone depths are promising target reservoir formations. A first assessment of the geothermal potential of the Karoo Basin is based on petro- and thermophysical data gained from an outcrop analogue study of Permian sandstones in the Eastern Cape Province, and evaluation of groundwater temperature and heat flow values from literature. A volumetric approach of the sandstones' reservoir potential leads to a first estimation of 2240 TWh (8.0 EJ) of power generation within the central and southern part of the basin. Comparison with data from other sedimentary basins where deep geothermal reservoirs are identified shows the high potential of the Karoo for future geothermal resource exploration, development and production. The mainly low permeability lithotypes may be operated as stimulated systems, depending on the fracture porosity in the deeper subsurface. In some areas auto-convective thermal water circulation might be expected and direct heat use becomes reasonable. The data presented here serve to identify exploration areas and are valuable attributes for reservoir modeling, contributing to (1) a reliable reservoir prognosis, (2) the decision of potential reservoir stimulation, and (3) the planning of long-term efficient reservoir utilization.

  12. Sleep in a Gymnasium: A Study to Examine the Psychophysiological and Environmental Conditions in Shelter-Analogue Settings

    Directory of Open Access Journals (Sweden)

    Koh Mizuno

    2016-11-01

    Full Text Available We aimed to examine sleep in shelter-analogue settings to determine the sleep and environmental conditions in evacuation shelters. A summer social/educational event was conducted in an elementary school, wherein children and their parents (n = 109 spent one night in the school gymnasium; a total of 15 children and 7 adults completed the study. Data were recording using wrist actigraphy and questionnaires, from two days before the event to two days after the event. During the night in the gymnasium, sleep initiation in the children was found to be significantly delayed, whereas adults did not show any significant change in actigraphic sleep parameters. Although 57% of adults complained of stiffness of the floor, only 7% of children had the same complaint. The nocturnal noise recorded at four locations in the gymnasium showed that the percentage of 1-min data epochs with a noise level >40 dB ranged from 53% to 74% during lights-out. The number of subjects that woke up during the night showed a similar pattern with the changes in the noise level. The changes in sleep might represent event-specific responses, such as to a noisy environment, and the different complaints between adults and children could be useful in shelter management.

  13. Cyclotron resonance studies on InAs/GaSb heterostructures

    Energy Technology Data Exchange (ETDEWEB)

    Petchsingh, Cattleya

    2002-07-01

    Far-infrared cyclotron resonance is used to study the magneto-optical properties of semimetallic InAs/GaSb heterostructures. Spatially separated two-dimensional electron and hole gases coexist in this 'broken-gap' type-ll system due to charge transfer across the interfaces. Hybridisations of the overlapping electron and hole wavefunctions are investigated experimentally in samples of varying growth parameters. A self-consistent 8-band k{center_dot}p model is used to assist in the interpretation of experimental results. In samples subjected to varying magnetic field, hybridisations result in oscillations of cyclotron resonance mass, amplitude and linewidth, accompanied by transition splittings in the vicinity of Landau level anticrossings. Asymmetries introduced by InSb interface biasing enhance these effects. Comparison of samples with varying confinement energies (at specified magnetic field) shows effective mass enhancement greater than the standard nonparabolicity effect. The mass enhancement increases with hybridisation strength. A simple two-band minigap model gives good agreement with experimental results. Tilled field measurements show that hybridisation suppresses electron cyclotron resonance transitions. Increased resonance amplitudes at higher temperatures are therefore ascribed to reduced hybridisation strength. Strong evidence of Coulomb interactions between different single particle transitions shows the interactions increasing with temperature, leading to a single motion-averaged transition at sufficiently high temperature. High magnetic field measurements near the quantum limit show transition features generally consistent with electron-hole Landau level hybridisation. Multiple splittings in this field range (14-27T) are ascribed to spin splitting and subband coupling effects. Breaking of selection rules is suggested to be due to inherent band asymmetries in the samples. For narrow well samples, some transition features remain unexplained

  14. Isatin Derived Spirocyclic Analogues with α-Methylene-γ-butyrolactone as Anticancer Agents: A Structure-Activity Relationship Study.

    Science.gov (United States)

    Rana, Sandeep; Blowers, Elizabeth C; Tebbe, Calvin; Contreras, Jacob I; Radhakrishnan, Prakash; Kizhake, Smitha; Zhou, Tian; Rajule, Rajkumar N; Arnst, Jamie L; Munkarah, Adnan R; Rattan, Ramandeep; Natarajan, Amarnath

    2016-05-26

    Design, synthesis, and evaluation of α-methylene-γ-butyrolactone analogues and their evaluation as anticancer agents is described. SAR identified a spirocyclic analogue 19 that inhibited TNFα-induced NF-κB activity, cancer cell growth and tumor growth in an ovarian cancer model. A second iteration of synthesis and screening identified 29 which inhibited cancer cell growth with low-μM potency. Our data suggest that an isatin-derived spirocyclic α-methylene-γ-butyrolactone is a suitable core for optimization to identify novel anticancer agents.

  15. In Vitro Membrane Permeation Studies and in Vivo Antinociception of Glycosylated Dmt(1)-DALDA Analogues

    DEFF Research Database (Denmark)

    Ballet, Steven; Betti, Cecilia; Novoa, Alexandre;

    2014-01-01

    In this study the μ opioid receptor (MOR) ligands DALDA (Tyr-d-Arg-Phe-Lys-NH2) and Dmt(1)-DALDA (Dmt-d-Arg-Phe-Lys-NH2, Dmt = 2',6'-dimethyltyrosine) were glycosylated at the N- or C-terminus. Subsequently, the modified peptides were subjected to in vitro and in vivo evaluation. In contrast to t...

  16. Measuring fast-temporal sediment fluxes with an analogue acoustic sensor: a wind tunnel study

    NARCIS (Netherlands)

    Poortinga, A.; Minnen, van J.; Keijsers, J.G.S.; Riksen, M.J.P.M.; Goossens, D.; Seeger, K.M.

    2013-01-01

    In aeolian research, field measurements are important for studying complex wind-driven processes for land management evaluation and model validation. Consequently, there have been many devices developed, tested, and applied to investigate a range of aeolian-based phenomena. However, determining the

  17. Preliminaries toward studying resonant extraction from the Debuncher

    Energy Technology Data Exchange (ETDEWEB)

    Michelotti, Leo; Johnstone, John; /Fermilab

    2009-06-01

    A recent proposal to detect {mu} {yields} e direct conversion at Fermilab asks for slow extraction of protons from the antiproton source, specifically from the Debuncher. [1] A third-integer resonance originally was considered for this, partly because of the Debuncher's three-fold symmetry and partly because its operational horizontal tune, {nu}{sub x} {approx} 9.765, is already within 0.1 of {nu}{sub x} = 29/3. Using a half integer resonance, {nu}{sub x} = 19/2, though not part of the original proposal, has been suggested more recently because (a) Fermilab has had a good deal of experience with half-integer extraction from the Tevatron, the Main Injector and the erstwhile Main Ring, and (b) for reasons we shall examine later, it depopulates the entire bunch without an abort at the end. This memo presents considerations preliminary to studying both possibilities. It is meant only as a starting point for investigations to be carried out in the future. The working constraints and assumptions have oscillated between two extremes: (1) making minimal changes in the antiproton source to minimize cost and (2) building another machine in the same tunnel. In this memo we adopt an attitude aligned more toward the first. The assumed parameters are listed in Table 1. A few are not (easily) subject to change, such as those related to the beam's momentum and revolution frequency and the acceptance of the debuncher. Two resonance exemplars are presented in the next section, with an explanation of the analytic and semi-analytic calculations that can be done for each. Section 3 contains preliminary numerical work that was done to validate the exemplars within the context of extraction from the Debuncher. A final section contains a summary. Following the bibliography, appendices contain (a) a qualitative, conceptual discussion of extraction for the novice, (b) a telegraphic review of the perturbative incantations used to filter the exemplars as principal resonances of

  18. 3D-QSAR study and design of 4-hydroxyamino α-pyranone carboxamide analogues as potential anti-HCV agents

    Science.gov (United States)

    Li, Wenlian; Xiao, Faqi; Zhou, Mingming; Jiang, Xuejin; Liu, Jun; Si, Hongzong; Xie, Meng; Ma, Xiuting; Duan, Yunbo; Zhai, Honglin

    2016-09-01

    The three dimensional-quantitative structure activity relationship (3D-QSAR) study was performed on a series of 4-hydroxyamino α-pyranone carboxamide analogues using comparative molecular similarity indices analysis (COMSIA). The purpose of the present study was to develop a satisfactory model providing a reliable prediction based on 4-hydroxyamino α-pyranone carboxamide analogues as anti-HCV (hepatitis C virus) inhibitors. The statistical results and the results of validation of this optimum COMSIA model were satisfactory. Furthermore, analysis of the contour maps helped to provide guidelines for finding structural requirement. Therefore, the satisfactory results from this study may provide useful guidelines for drug development of anti-HCV inhibitors.

  19. Astrobiology in the Field: Studying Mars by Analogue Expeditions on Earth

    Science.gov (United States)

    Conrad, Pamela G.

    2011-01-01

    We will present a strategy for how one prepares to engage in fieldwork on another planets by practicing in analogous environments on the Earth, including at Mono Lake. As an example, we will address the problem of how to study the habitability of an environment when you have no idea what kind of life might be there to exploit it. This will all be related to the upcoming launch of the Mars Science Laboratory to Mars in late November this year.

  20. Synthesis, characterization, electrochemical studies and antitumor activity of some new chalcone analogues containing ferrocenyl pyrazole moiety.

    Science.gov (United States)

    Ratković, Zoran; Juranić, Zorica D; Stanojković, Tatjana; Manojlović, Dragan; Vukićević, Rastko D; Radulović, Niko; Joksović, Milan D

    2010-02-01

    A series of new alpha,beta-unsaturated conjugated ketones containing ferrocenyl pyrazole unit were synthesized and fully characterized by IR and NMR spectroscopy. Electrochemical characterization of subject compounds was performed by means of cyclic voltametry. The in vitro cytotoxic activity of all the synthesized compounds was studied against cervix adenocarcinoma HeLa, melanoma Fem-x and myelogenous leukemia K562 cell lines by the MTT method. Derivative 1l containing 3-pyridyl moiety exhibited a better cytotoxic activity in the cell growth inhibition of K562 cell lines in comparison with cisplatin as a reference compound.

  1. The use of messages in altering risky gambling behavior in college students: an experimental analogue study.

    Science.gov (United States)

    Jardin, Bianca; Wulfert, Edelgard

    2009-01-01

    This study examined the effects of messages on altering risky gambling behavior in college students. While playing a chance-based computerized game with play money, three groups of participants either viewed occasional accurate messages that correctly described the contingencies of the game, neutral messages unrelated to the contingencies, or no messages. Participants in the accurate message condition spent overall less money gambling, played fewer trials in the final phase of the game when all trials resulted in losses, and were more likely to quit the game while they still had money remaining in the bank. The findings suggest that "reminders" about the random nature of games and the overall negative rate of return might lead to more responsible gaming.

  2. Structural studies on the reaction of isopenicillin N synthase with the substrate analogue delta-(l-alpha-aminoadipoyl)-l-cysteinyl-d-alpha-aminobutyrate.

    Science.gov (United States)

    Long, Alexandra J; Clifton, Ian J; Roach, Peter L; Baldwin, Jack E; Schofield, Christopher J; Rutledge, Peter J

    2003-06-15

    Isopenicillin N synthase (IPNS) is a non-haem iron(II) oxidase which catalyses the biosynthesis of isopenicillin N from the tripeptide delta-(L-alpha-aminoadipoyl)-L-cysteinyl-D-valine (ACV). Herein we report crystallographic studies to investigate the reaction of IPNS with the truncated substrate analogue delta-(L-alpha-aminoadipoyl)-L-cysteinyl-D-alpha-aminobutyrate (ACAb). It has been reported previously that this analogue gives rise to three beta-lactam products when incubated with IPNS: two methyl penams and a cepham. Crystal structures of the IPNS-Fe(II)-ACAb and IPNS-Fe(II)-ACAb-NO complexes have now been solved and are reported herein. These structures and modelling studies based on them shed light on the diminished product selectivity shown by IPNS in its reaction with ACAb and further rationalize the presence of certain key residues at the IPNS active site.

  3. Analogue studies in the Alligator Rivers Region of Australia. Contribution to the scientific basis for the performance assessment of proposed repository sites

    Energy Technology Data Exchange (ETDEWEB)

    Garnett, H.M.; Airey, P.L. [Australian Nuclear Science and Technology Organisation, Lucas Heights, NSW (Australia); Sekine, Keiichi; Hahn, Pil-Soo; Ott, W.R.; Pescatore, C.

    1996-10-01

    The Analogue Studies in the Alligator Rivers Region (ASARR) project is coordinated by the OECD/NEA and involves ANSTO, JAERI, KAERI and the USNRC. Its aim is to contribute to the performance assessment of nuclear waste disposal sites through the building of confidence in predictive transport codes. The project is principally concerned with validating models of sub-surface retardation processes which underpin the codes. This paper will describe recent progress in extending sorption studies from reference minerals to natural materials. The first step in the laboratory program was to investigate uranium uptake on binary systems comprising ferrihydrite and kaolinite. Secondly, the significance of small levels of active minerals such as anatase in a standard kaolinite and iron nodules in geological samples from the Koongarra Uranium deposit is being assessed. Progress towards applying the natural analogue approach to a reference arid site will be reported. The scientific approaches of the individual laboratories are outlined in an annex. (author)

  4. Collaborative Student Laboratory Exercise Using FT-IR Spectroscopy for the Kinetics Study of a Biotin Analogue

    Science.gov (United States)

    Leong, Jhaque; Ackroyd, Nathan C.; Ho, Karen

    2014-01-01

    The synthesis of N-methoxycarbonyl-2-imidazolidone, an analogue of biotin, was conducted by organic chemistry students and confirmed using FT-IR and H NMR. Spectroscopy students used FT-IR to measure the rate of hydrolysis of the product and determined the rate constant for the reaction using the integrated rate law. From the magnitude of the rate…

  5. A theoretical study of porphyrin isomers and their core-modified analogues: cis-trans isomerism, tautomerism and relative stabilities

    Indian Academy of Sciences (India)

    M Punnagai; Saju Joseph; G Narahari Sastry

    2004-08-01

    Semiempirical (AM1 and PM3) and density functional theory (DFT) calculations were performed on about 50 porphyrin isomers with 25 each of 1,2 (syn) and 1,3 (anti) tautomeric forms. The corresponding oxa- and thia-core-modified analogues were also computed. The variations of relative energies and stabilities of the core-modified analogues were compared with parent porphyrin 1 and the corresponding oxa- and thia-analogues. The trends in relative energies are not significantly changed while going from parent system to oxa- and thia-core-modified porphyrins in case of both syn and anti tautomers. Isomers of types [2.2.0.0], [3.0.1.0], [3.1.0.0], and [4.0.0.0] are destabilized due to the absence of methine bridge, which results in angle strain for tetrapyrroles. Isomers having [2.1.1.0], [2.1.0.1], [2.0.2.0] and [2.2.0.0] connectivity, the isomers, are more stable compared to the corresponding isomers in both syn and anti forms of parent and core-modified analogues.

  6. The study of disk resonators diode modules, solid-state generators active

    Directory of Open Access Journals (Sweden)

    B. A. Kotserzhinskii

    1987-12-01

    Full Text Available The results of an experimental study of disk resonators diode modules, solid-state active microwave generators. The effect of current leads, as well as errors in the manufacture of resonators their characteristics.

  7. Molecular modeling studies, synthesis and biological evaluation of dabigatran analogues as thrombin inhibitors.

    Science.gov (United States)

    Dong, Ming-Hui; Chen, Hai-Feng; Ren, Yu-Jie; Shao, Fang-Ming

    2016-01-15

    In this work, 48 thrombin inhibitors based on the structural scaffold of dabigatran were analyzed using a combination of molecular modeling techniques. We generated three-dimensional quantitative structure-activity relationship (3D-QSAR) models based on three alignments for both comparative molecular field analysis (CoMFA) and comparative molecular similarity index analysis (CoMSIA) to highlight the structural requirements for thrombin protein inhibition. In addition to the 3D-QSAR study, Topomer CoMFA model also was established with a higher leave-one-out cross-validation q(2) and a non-cross-validation r(2), which suggest that the three models have good predictive ability. The results indicated that the steric, hydrophobic and electrostatic fields play key roles in QSAR model. Furthermore, we employed molecular docking and re-docking simulation explored the binding relationship of the ligand and the receptor protein in detail. Molecular docking simulations identified several key interactions that were also indicated through 3D-QSAR analysis. On the basis of the obtained results, two compounds were designed and predicted by three models, the biological evaluation in vitro (IC50) demonstrated that these molecular models were effective for the development of novel potent thrombin inhibitors.

  8. Resonance Energy Transfer-Based Approaches to Study GPCRs.

    Science.gov (United States)

    Ayoub, Mohammed Akli

    2016-01-01

    Since their discovery, G protein-coupled receptors (GPCRs) constitute one of the most studied proteins leading to important discoveries and perspectives in terms of their biology and implication in physiology and pathophysiology. This is mostly linked to the remarkable advances in the development and application of the biophysical resonance energy transfer (RET)-based approaches, including bioluminescence and fluorescence resonance energy transfer (BRET and FRET, respectively). Indeed, BRET and FRET have been extensively applied to study different aspects of GPCR functioning such as their activation and regulation either statically or dynamically, in real-time and intact cells. Consequently, our view on GPCRs has considerably changed opening new challenges for the study of GPCRs in their native tissues in the aim to get more knowledge on how these receptors control the biological responses. Moreover, the technological aspect of this field of research promises further developments for robust and reliable new RET-based assays that may be compatible with high-throughput screening as well as drug discovery programs.

  9. A laboratory study of meteor smoke analogues: Composition, optical properties and growth kinetics

    Science.gov (United States)

    Saunders, Russell W.; Plane, John M. C.

    2006-12-01

    Meteoric smoke forms in the mesosphere from the recondensation of the metallic species and silica produced by meteoric ablation. A photochemical flow reactor was used to generate meteoric smoke mimics using appropriate photolytic precursors of Fe and Si atoms in an excess of oxidant. The following systems were studied: (i) Fe+O3/O2, (ii) Fe+O3/O2+H2O, (iii) Fe+Si/SiO+O3/O2 and (iv) Si/SiO+O3/O2. The resulting nano-particles were captured for imaging by transmission electron microscopy, combined with elemental analysis using X-ray (EDX) and electron energy loss (EELS) techniques. These systems generated particle compositions consistent with: (i) Fe2O3 (hematite), (ii) FeOOH (goethite), (iii) Fe2SiO4 (fayalite) and (iv) SiO2 (silica). Electron diffraction revealed that the Fe-containing particles were entirely amorphous, while the SiO2 particles displayed some degree of crystallinity. The Fe-containing particles formed fractal aggregates with chain-like morphologies, whereas the SiO2 particles were predominantly spherical and compact in appearance. The optical extinction spectra of the Fe-containing particles were measured from 300 nmcoagulation. This was modelled by assuming an initial period of coalescent particle growth resulting from diffusional (Brownian) coagulation to form primary particles; further growth of these particles is then dominated by long-range magnetic dipole dipole interactions, leading to the fractal aggregates observed. The atmospheric implications of this work are then discussed.

  10. Natural glass analogues to alteration of nuclear waste glass: A review and recommendations for further study

    Energy Technology Data Exchange (ETDEWEB)

    McKenzie, W.F.

    1990-01-01

    The purpose of this report is to review previous work on the weathering of natural glasses; and to make recommendations for further work with respect to studying the alteration of natural glasses as it relates quantifying rates of dissolution. the first task was greatly simplified by the published papers of Jercinovic and Ewing (1987) and Byers, Jercinovic, and Ewing (1987). The second task is obviously the more difficult of the two and the author makes no claim of completeness in this regard. Glasses weather in the natural environment by reacting with aqueous solutions producing a rind of secondary solid phases. It had been proposed by some workers that the thickness of this rind is a function of the age of the glass and thus could be used to estimate glass dissolution rates. However, Jercinovic and Ewing (1987) point out that in general the rind thickness does not correlate with the age of the glass owing to the differences in time of contact with the solution compared to the actual age of the sample. It should be noted that the rate of glass dissolution is also a function of the composition of both the glass and the solution, and the temperature. Quantification of the effects of these parameters (as well as time of contact with the aqueous phase and flow rates) would thus permit a prediction of the consequences of glass-fluid interactions under varying environmental conditions. Defense high- level nuclear waste (DHLW), consisting primarily of liquid and sludge, will be encapsulated by and dispersed in a borosilicate glass before permanent storage in a HLW repository. This glass containing the DHLW serves to dilute the radionuclides and to retard their dispersion into the environment. 318 refs.

  11. Pico de Orizaba as an analogue to study planetary ecosynthesis on Mars

    Science.gov (United States)

    Navarro-González, R.

    2010-03-01

    Studies of Mars by spacecrafts, landers and rovers have indicated that it was once a wetter, more habitable world than the cold desert planet of today. If water was once stable as a liquid on the surface and flowed in such vast quantities, then the atmosphere must have been denser and the climate warmer in the past. The same processes that led to the origin of life on Earth may have occurred simultaneously on Mars, and living organisms may have colonized the planet. It is unclear how or when Mars lost its thicker atmosphere and as a result lost its habitable environment. The Viking landers of the mid-1970s carried experiments designed to detect the presence of extant life and showed the martian soil to be lifeless on the surface. Future space missions will continue to explore if there was or still is life on Mars, perhaps in the subsurface. However, if there is no life on Mars, there is an opportunity to explore the potential for survival and biological evolution for terrestrial life beyond their place of origin, and do planetary ecosynthesis on Mars, a process of making the planet habitable for terrestrial organisms. The evidence that Mars was once habitable is important for planetary ecosynthesis as it provides a proof in principle that Mars can support a habitable state on timescales that, while short over the age of the solar system, are long in human terms. Artificial greenhouse gases, such as perfluorocarbons, appear to be the best method for warming Mars and increase its atmospheric density so that liquid water becomes stable. The process of introducing terrestrial ecosystems to Mars can be compared with a descent down a high mountain. Each drop in elevation results in a warmer, wetter climate and more diverse biological community. This is shown in Pico de Orizaba which is located at 19.03°N, 97.27°W and rises 5,636 meters above sea level. It is the highest mountain in Mexico, the third highest in the tropics after Mount Kilimanjaro (5,892) in Tanzania and

  12. QSAR analyses of DDT analogues and their in silico validation using molecular docking study against voltage-gated sodium channel of Anopheles funestus.

    Science.gov (United States)

    Saini, V; Kumar, A

    2014-01-01

    DDT has enjoyed the reputation of a successful pesticide in disease control programme and agricultural practices along with the serious opposition and ban later on due to its biomagnification and toxic action against non-target organisms. The present work was carried out to develop QSAR models for analysing DDT analogues for their pesticidal activity and in silico validation of these models. A 2D-QSAR model was generated using stepwise with multiple regression, and the model with a value of r(2) = 0.7324; q(2) = 0.6215; pred r(2) = 0.7038, containing five descriptors, was selected for further study. The 3D QSAR with CoMFA analysis showed that steric contribution of 21% and electrostatic contribution of about 79% were required for larvicidal activity of DDT analogues. A set of 3430 molecules was generated using the basic DDT skeleton as template, and these were evaluated for their mosquito larvicidal activity using the generated QSAR models and DDT as standard. Eleven molecules were selected for in silico validation of these models. For this, a docking study of the selected molecules against the homology-modelled voltage-gated sodium channel of Anopheles funestus was conducted. The study showed that the activities of these analogues as predicted by 2D-QSAR, 3D-QSAR with CoMFA and dock score were observed to be well correlated.

  13. Comparative study of the effect of BPA and its selected analogues on hemoglobin oxidation, morphological alterations and hemolytic changes in human erythrocytes.

    Science.gov (United States)

    Maćczak, Aneta; Bukowska, Bożena; Michałowicz, Jaromir

    2015-01-01

    Bisphenol A (BPA) has been shown to provoke many deleterious impacts on human health, and thus it is now successively substituted by BPA analogues, whose effects have been poorly investigated. Up to now, only one study has been realized to assess the effect of BPA on human erythrocytes, which showed its significant hemolytic and oxidative potential. Moreover, no study has been conducted to evaluate the effect of BPA analogues on red blood cells. The purpose of the present study was to compare the impact of BPA and its selected analogues such as bisphenol F (BPF), bisphenol S (BPS) and bisphenol AF (BPAF) on hemolytic and morphological changes and hemoglobin oxidation (methemoglobin formation) of human erythrocytes. The erythrocytes were incubated with different bisphenols concentrations ranging from 0.5 to 500μg/ml for 1, 4 and 24h. The compounds examined caused hemolysis in human erythrocytes with BPAF exhibiting the strongest effect. All bisphenols examined caused methemoglobin formation with BPA inducing the strongest oxidative potential. Flow cytometry analysis showed that all bisphenols (excluding BPS) induced significant changes in erythrocytes size. Changes in red blood cells shape were conducted using phase contrast microscopy. It was noticed that BPA and BPAF induced echinocytosis, BPF caused stomatocytosis, while BPS did not provoke significant changes in shape of red blood cells. Generally, the results showed that BPS, which is the main substituent of bisphenol A in polymers and thermal paper production, exhibited significantly lower disturbance of erythrocyte functions than BPA.

  14. Study on electrostatic resonance of nanoprisms with sharp corners

    Science.gov (United States)

    Chan, Wai Soen; Ng, Ka Ki; Yu, Kin Wah

    2015-03-01

    We have studied the electrostatic resonance of metal nanoprisms with sharp corners numerically. We consider an infinite metal cylinder with polygonal base, e.g. square. The incident electric field lies in the plane of cross-section of the cylinder. Yu and co-workers proposed Green's function formalism (GFF) to numerically calculate the electric potential and field distribution in plasmonic systems. We will adopt the scheme to demonstrate the effect of sharp corners, particularly on the effect of electrostatic resonance spectrum, as in the spectral analysis proposed by Bergman and Milton. Hetherington and Thorpe investigated the conductivity of a sheet containing dilute inclusion with sharp corners, they made use of a conformal mapping approach to calculate the conductivity from circular inclusions. Helsing, McPhedran and Milton also investigated the optical properties of a metamaterial lattice with inclusions having sharp corners. We study the possibility of improving numerical accuracy by combining the conformal mapping approach and GFF. We may extend similar approach to investigate the properties of plasmonic systems, for examples nanoboties and nanostars.

  15. Carcinogenicity of insulin analogues

    NARCIS (Netherlands)

    Braak, Sebastiaan Johannes ter

    2015-01-01

    There is epidemiological evidence that the use of some insulin analogues by diabetic patients is correlated with an increased cancer risk. In vitro exposure experiments revealed that insulin glargine (LANTUS) was the only commercial insulin analogue with an increased mitogenic potential. In the huma

  16. In vitro and In Silico Studies on Curcumin and Its Analogues as Dual Inhibitors for cyclooxygenase-1 (COX-1 and cyclooxygenase-2 (COX-2

    Directory of Open Access Journals (Sweden)

    Nunung Yuniarti

    2012-03-01

    Full Text Available Curcumin has been widely reported as an anti-inflammatory agent isolated from the plant Curcuma longa L. (turmeric. This anti-inflammatory activity was associated with the ability of this compound to inhibit the activity of both cyclooxygenase-1 (COX-1 and cyclooxygenase-2 (COX-2 in arachidonic acid metabolism. Dual COX-1 and COX-2 inhibitors are preferred to be employed in the therapy of chronic inflammatory diseases compared to selective inhibitors, since it was reported that the use of selective inhibitors led to severe adverse side effect. In the present study, in vitro and in silico assays on curcumin and its analogues as dual inhibitors for both COX-1 and COX-2 were performed. The results provide theoretical contribution in understanding the ligand-protein interactions at the molecular level to develop new curcumin analogues which possess better anti-inflammatory activity as well as to avoid unsolicited side effects.

  17. Studies of Nucleon Resonance Structure in Exclusive Meson Electroproduction

    Energy Technology Data Exchange (ETDEWEB)

    Aznauryan, Inna G. [Yerevan Physics Institute, JLAB; Bashir, Adnan; Braun, Vladimir M.; Brodsky, Stanley J. [SLAC; Burkert, Volker D. [JLAB; Chang, L.; Chen, Ch.; El-Bennich, Bruno O.; Cloet, Ian C.; Cole, Philip L. [Idaho State U.; Edwards, Robert G. [JLAB; Fedotov, Gleb V. [South Carolina U.; Giannini, Mauro M.; Gothe, Ralf W. [South Carolina U.; Lin, Huey-Wen [Washington; Kroll, Peter; Lee, T.-S. H.; Melnitchouk, Wally [JLAB; Mokeev, Viktor I [JLAB; Pena, Maria Teresa [CFTP; Ramalho, Gilberto T.F. [CFTP; Roberts, Craig D. [ANL; Santopinto, Elena; De Teramond, Guy F.; Tsushima, Kazuo [Adelaide U.; Wilson, David J. [Old Dominion U.

    2013-06-01

    The studies of N* structure represent a key direction in the N* Program with CLAS detector. After 12 GeV Upgrade, the dedicated experiment on the studies of N* structure at largest photon virtualities ever achieved Q^2<12 GeV^2 is scheduled for the first year of running with the CLAS12 detector. The current status and plans for theory support of the N* structure studies in exclusive meson electroproduction are presented. They include the recent advances in the reaction theory for extraction of N* electrocouplings from the data and the approaches for high level theoretical interpretation of these fundamental quantities, allowing us to access dynamics of non-perturbative strong interaction which is responsible for the resonance formation and explore how it emerges from QCD.

  18. Review: Magnetic Resonance Spectroscopy Studies of Pediatric Major Depressive Disorder

    Directory of Open Access Journals (Sweden)

    Douglas G. Kondo

    2011-01-01

    Full Text Available Introduction. This paper focuses on the application of Magnetic Resonance Spectroscopy (MRS to the study of Major Depressive Disorder (MDD in children and adolescents. Method. A literature search using the National Institutes of Health's PubMed database was conducted to identify indexed peer-reviewed MRS studies in pediatric patients with MDD. Results. The literature search yielded 18 articles reporting original MRS data in pediatric MDD. Neurochemical alterations in Choline, Glutamate, and N-Acetyl Aspartate are associated with pediatric MDD, suggesting pathophysiologic continuity with adult MDD. Conclusions. The MRS literature in pediatric MDD is modest but growing. In studies that are methodologically comparable, the results have been consistent. Because it offers a noninvasive and repeatable measurement of relevant in vivo brain chemistry, MRS has the potential to provide insights into the pathophysiology of MDD as well as the mediators and moderators of treatment response.

  19. Survey of analogue spacetimes

    CERN Document Server

    Visser, Matt

    2013-01-01

    Analogue spacetimes, (and more boldly, analogue models both of and for gravity), have attracted significant and increasing attention over the last decade and a half. Perhaps the most straightforward physical example, which serves as a template for most of the others, is Bill Unruh's model for a dumb hole, (mute black hole, acoustic black hole), wherein sound is dragged along by a moving fluid --- and can even be trapped behind an acoustic horizon. This and related analogue models for curved spacetimes are useful in many ways: Analogue spacetimes provide general relativists with extremely concrete physical models to help focus their thinking, and conversely the techniques of curved spacetime can sometimes help improve our understanding of condensed matter and/or optical systems by providing an unexpected and countervailing viewpoint. In this introductory chapter, I shall provide a few simple examples of analogue spacetimes as general background for the rest of the contributions.

  20. Global profiling and rapid matching of natural products using diagnostic product ion network and in silico analogue database: Gastrodia elata as a case study.

    Science.gov (United States)

    Lai, Chang-Jiang-Sheng; Zha, Liangping; Liu, Da-Hui; Kang, Liping; Ma, Xiaojing; Zhan, Zhi-Lai; Nan, Tie-Gui; Yang, Jian; Li, Fajie; Yuan, Yuan; Huang, Lu-Qi

    2016-07-22

    Rapid discovery of novel compounds of a traditional herbal medicine is of vital significance for pharmaceutical industry and plant metabolic pathway analysis. However, discovery of unknown or trace natural products is an ongoing challenge. This study presents a universal targeted data-independent acquisition and mining strategy to globally profile and effectively match novel natural product analogues from an herbal extract. The famous medical plant Gastrodia elata was selected as an example. This strategy consists of three steps: (i) acquisition of accurate parent and adduct ions (PAIs) and the product ions data of all eluting compounds by untargeted full-scan MS(E) mode; (ii) rapid compound screening using diagnostic product ions (DPIs) network and in silico analogue database with SUMPRODUCT function to find novel candidates; and (iii) identification and isomerism discrimination of multiple types of compounds using ClogP and ions fragment behavior analyses. Using above data mining methods, a total of 152 compounds were characterized, and 70 were discovered for the first time, including series of phospholipids and novel gastroxyl derivatives. Furthermore, a number of gastronucleosides and phase II metabolites of gastrodin and parishins were discovered, including glutathionylated, cysteinylglycinated and cysteinated compounds, and phosphatidylserine analogues. This study extended the application of classical DPIs filter strategy and developed a structure-based screening approach with the potential for significant increase of efficiency for discovery and identification of trace novel natural products.

  1. Facies-architecture of fossil arid siliciclastic depositional systems as outcrop analogue for Rotliegend reservoirs. Literature study; Faziesarchitektur fossiler arid-klastischer Ablagerungsraeume als Rotliegend-Reservoiranalog. Literaturstudie

    Energy Technology Data Exchange (ETDEWEB)

    Irmen, A.

    1999-08-01

    In this project a literature-based study was carried out in order to document the facies-architecture of siliciclastic sediments from arid environments and to investigate their suitability as outcrop-analogues for the strata of the Southern Permian Basin. The report resulting from this investigation presents possible analogues and case-studies. Three Formations (Flechtingen Sandstone, Corrie Sandstone and Cedar Mesa Sandstone of the Cutler Group) are especially well suited to serve as outcrop analogue for the 'Rotliegend' Sediments of the Southern Permian Basin. Possible analogues are documented at various scales, ranging from bed-scale to formation scale. Also, special attention was paid to general trends and what factors control them. To make a comparison of Formations from different settings possible, criteria were elaborated to qualify the relevant controlling factors. The catalog itself is preceded by a comprehensive preface, that introduces to the subject and points out the connection between the primary sediment fabric and its petrophysical properties. (orig.) [German] Im Rahmen dieses DGMK Forschungsvorhabens wurde eine Literaturstudie durchgefuehrt, welche die Faziesarchitektur fossiler arid-klastischer Sedimente darstellt und auf ihre Eignung als Rotliegend-Reservoiranalog untersucht. Die vorliegende Dokumentation stellt verschiedene moegliche Analoge und Fallbeispiele dar, wobei drei Abfolgen als besonders geeignet erscheinen. Es wurden Kriterien erarbeitet, die relevante Kontrollfaktoren qualifizieren, um einen Vergleich verschiedener arid-klastischer Sedimentationsraeume zu ermoeglichen. Die Bandbreite der Darstellung moeglicher Analoge umfasst das gesamte Spektrum vom Gefuegemassstab bis hin zu genetischen Einheiten und beleuchtet die jeweiligen Steuerungsfaktoren der Ablagerung. Der eigentlichen Dokumentation wurde eine umfassende Einleitung vorangestellt, welche in die Thematik einfuehrt und Zusammenhaenge zwischen primaerem

  2. Strategy and methodology of dynamical analogue prediction

    Institute of Scientific and Technical Information of China (English)

    2007-01-01

    In order to effectively improve numerical prediction level by using current models and data, the strategy and methodology of dynamical analogue prediction (DAP) is deeply studied in the present paper. A new idea to predict the prediction errors of dynamical model on the basis of historical analogue information is put forward so as to transform the dynamical prediction problem into the estimation problem of prediction errors. In terms of such an idea, a new prediction method of final analogue correction of errors (FACE) is developed. Furthermore, the FACE is applied to extra-seasonal prediction experiments on an operational atmosphere-ocean coupled general circulation model. Prediction results of summer mean circulation and total precipitation show that the FACE can to some extent reduce prediction errors, recover prediction variances, and improve prediction skills. Besides, sensitive experiments also show that predictions based on the FACE are evidently influenced by the number of analogues, analogue-selected variables and analogy metric.

  3. Study of resonant reactions with radioactive ion beams

    CERN Document Server

    Galindo-Uribarri, A; Chavez, E; Gomez-Del Campo, J; Gross, C J; Huerta, A; Liang, J F; Ortiz, M E; Padilla, E; Pascual, S; Paul, S D; Shapira, D; Stracener, D W; Varner, R L

    2000-01-01

    A fast and efficient method to study (p,p) and (p,alpha) resonances with radioactive beams in inverse kinematics is described. It is based on the use of thick targets and large area double-sided silicon strip detectors (DSSDs) to detect the recoiling light-charged particles and to determine precisely their scattering angle. The first nuclear physics experiments with the technique have been performed recently at the Holifield Radioactive Ion Beam Facility (HRIBF) at Oak Ridge with stable beams of sup 1 sup 7 O and radioactive beams of sup 1 sup 7 F. The high-quality resonance measurements obtained demonstrate the capabilities of the technique. Pure sup 1 sup 7 F beams from HRIBF were produced by fully stripping the ions and separating the interfering and more abundant sup 1 sup 7 O ions by the beam transport system. The removal of interfering isobars is one of the various common challenges to both accelerator mass spectrometry (AMS) and radioactive ion beam (RIB) production. Experiments done with RIBs will ben...

  4. Partial volume effects in dynamic contrast magnetic resonance renal studies

    Energy Technology Data Exchange (ETDEWEB)

    Gutierrez, D. Rodriguez, E-mail: drodriguez@biotronics3d.co [CVSSP, Faculty of Engineering and Physical Sciences, University of Surrey (United Kingdom); Wells, K., E-mail: k.wells@surrey.ac.u [CVSSP, Faculty of Engineering and Physical Sciences, University of Surrey (United Kingdom); Diaz Montesdeoca, O., E-mail: o.diaz.montesdeoca@gmail.co [EUITT, Universidad de Las Palmas de Gran Canaria (Spain); Moran Santana, A. [EUITT, Universidad de Las Palmas de Gran Canaria (Spain); Mendichovszky, I.A., E-mail: iosifm@hotmail.co [Radiology and Physics Unit, UCL Institute of Child Health, London WC1N 1EH (United Kingdom); Gordon, I., E-mail: i.gordon@ich.ucl.ac.u [Radiology and Physics Unit, UCL Institute of Child Health, London WC1N 1EH (United Kingdom)

    2010-08-15

    This is the first study of partial volume effect in quantifying renal function on dynamic contrast enhanced magnetic resonance imaging. Dynamic image data were acquired for a cohort of 10 healthy volunteers. Following respiratory motion correction, each voxel location was assigned a mixing vector representing the 'overspilling' contributions of each tissue due to the convolution action of the imaging system's point spread function. This was used to recover the true intensities associated with each constituent tissue. Thus, non-renal contributions from liver, spleen and other surrounding tissues could be eliminated from the observed time-intensity curves derived from a typical renal cortical region of interest. This analysis produced a change in the early slope of the renal curve, which subsequently resulted in an enhanced glomerular filtration rate estimate. This effect was consistently observed in a Rutland-Patlak analysis of the time-intensity data: the volunteer cohort produced a partial volume effect corrected mean enhancement of 36% in relative glomerular filtration rate with a mean improvement of 7% in r{sup 2} fitting of the Rutland-Patlak model compared to the same analysis undertaken without partial volume effect correction. This analysis strongly supports the notion that dynamic contrast enhanced magnetic resonance imaging of kidneys is substantially affected by the partial volume effect, and that this is a significant obfuscating factor in subsequent glomerular filtration rate estimation.

  5. Nuclear magnetic resonance studies of macroscopic morphology and dynamics

    Energy Technology Data Exchange (ETDEWEB)

    Barrall, Geoffrey Alden [Univ. of California, Berkeley, CA (United States). Dept. of Chemistry

    1995-09-01

    Nuclear magnetic resonance techniques are traditionally used to study molecular level structure and dynamics with a noted exception in medically applied NMR imaging (MRI). In this work, new experimental methods and theory are presented relevant to the study of macroscopic morphology and dynamics using NMR field gradient techniques and solid state two-dimensional exchange NMR. The goal in this work is not to take some particular system and study it in great detail, rather it is to show the utility of a number of new and novel techniques using ideal systems primarily as a proof of principle. By taking advantage of the analogy between NMR imaging and diffraction, one may simplify the experiments necessary for characterizing the statistical properties of the sample morphology. For a sample composed of many small features, e.g. a porous medium, the NMR diffraction techniques take advantage of both the narrow spatial range and spatial isotropy of the sample`s density autocorrelation function to obtain high resolution structural information in considerably less time than that required by conventional NMR imaging approaches. The time savings of the technique indicates that NMR diffraction is capable of finer spatial resolution than conventional NMR imaging techniques. Radio frequency NMR imaging with a coaxial resonator represents the first use of cylindrically symmetric field gradients in imaging. The apparatus as built has achieved resolution at the micron level for water samples, and has the potential to be very useful in the imaging of circularly symmetric systems. The study of displacement probability densities in flow through a random porous medium has revealed the presence of features related to the interconnectedness of the void volumes. The pulsed gradient techniques used have proven successful at measuring flow properties for time and length scales considerably shorter than those studied by more conventional techniques.

  6. Synthesis, anti-inflammatory, analgesic, COX1/2-inhibitory activity, and molecular docking studies of hybrid pyrazole analogues

    Directory of Open Access Journals (Sweden)

    Alam MJ

    2016-10-01

    Full Text Available Md Jahangir Alam,1 Ozair Alam,1 Suroor Ahmad Khan,1 Mohd Javed Naim,1 Mohammad Islamuddin,2 Girdhar Singh Deora3 1Department of Pharmaceutical Chemistry, Faculty of Pharmacy, 2Parasite Immunology Laboratory, Department of Biotechnology, Faculty of Science, Jamia Hamdard, New Delhi, 3Institute of Life Sciences, University of Hyderabad, Hyderabad, India Abstract: This article reports on the design, synthesis, and pharmacological activity of a new series of hybrid pyrazole analogues: 5a–5u. Among the series 5a–5u, the compounds 5u and 5s exhibited potent anti-inflammatory activity of 80.63% and 78.09% and inhibition of 80.87% and 76.56% compared with the standard drug ibuprofen, which showed 81.32% and 79.23% inhibition after 3 and 4 hours, respectively. On the basis of in vivo studies, 12 compounds were selected for assessment of their in vitro inhibitory action against COX1/2 and TNFα. The compounds 5u and 5s showed high COX2-inhibitory activity, with half-maximal inhibitory concentrations of 1.79 and 2.51 µM and selectivity index values of 72.73 and 65.75, respectively, comparable to celecoxib (selectivity index =78.06. These selected compounds were also tested for TNFα, cytotoxicity, and ulcerogenicity. Docking studies were also carried out to determine possible interactions of the potent compounds (5u and 5s, which also showed high docking scores of -12.907 and -12.24 compared to celecoxib, with a -9.924 docking score. These selective COX2 inhibitors were docked into the active site of COX2, and showed the same orientation and binding mode to that of celecoxib (selective COX2 inhibitor. Docking studies also showed that the SO2NH2 of 5u and 5s is inserted deep inside the selective pocket of the COX2-active site and formed a hydrogen-bond interaction with His90, Arg513, Phe518, Ser353, Gln192, and Ile517, which was further validated by superimposed docked pose with celecoxib. Keywords: anti-inflammatory activity, analgesic activity

  7. Nuclear Magnetic Resonance Study of Nanoscale Ionic Materials

    KAUST Repository

    Oommen, Joanna Mary

    2010-08-13

    Nanoscale ionic materials (NIMs) are a new class of nanomaterials that exhibit interesting properties including negligible vapor pressures and tunable physical states, among others. In this study, we analyzed the temperature-wise performance of NIMs using nuclear magnetic resonance (NMR) spectroscopy. NIMs are relatively stable over a temperature range from 300 to 383 K, rendering them usable in high temperature applications. We confirmed the presence of covalent bonds between the SiO2 core and the sulfonate group and determined relative concentrations of aromatic and aliphatic hydrocarbons. These findings serve as first hand proof-of-concept for the usefulness of NMR analyses in further studies on the diffusive properties of NIMs. © 2010 The Electrochemical Society.

  8. The Electron Paramagnetic Resonance in the study of tissue specimens

    CERN Document Server

    Stefaniuk, Ireneusz; Skrȩt, Andrzej; Skrȩt-Magierło, Joanna; Góra, Tomasz; Szczerba, Piotr

    2014-01-01

    The Electron Paramagnetic Spectroscopy (EPR) is the most direct and powerful method for the detection and identification of free radicals and other species with unpaired electrons. Statistics disorders are a common gynaecological disorder occurring in women. The condition afflicts around 15% of women to the extent of impairing the quality of living. According to scientific reports as many as 50% of women experiencing problems related to genital statistics disorders. The aim of this work was to investigate tissue taken from women with genital statistics disorders using the Electron Paramagnetic Resonance method. The studies on the tissue of women is one of the first studies in this area. In this work we observed a close relationship between the observed EPR signal and the consumption of omega 3 acids.

  9. Electron cyclotron resonance breakdown studies in a linear plasma system

    Indian Academy of Sciences (India)

    Vipin K Yadav; K Sathyanarayana; D Bora

    2008-03-01

    Electron cyclotron resonance (ECR) plasma breakdown is studied in a small linear cylindrical system with four different gases - hydrogen, helium, argon and nitrogen. Microwave power in the experimental system is delivered by a magnetron at 2.45 ± 0.02 GHz in TE10 mode and launched radially to have extra-ordinary (X) wave in plasma. The axial magnetic field required for ECR in the system is such that the fundamental ECR surface ( = 875.0 G) resides at the geometrical centre of the plasma system. ECR breakdown parameters such as plasma delay time and plasma decay time from plasma density measurements are carried out at the centre using a Langmuir probe. The operating parameters such as working gas pressure (1 × 10-5 -1 × 10-2 mbar) and input microwave power (160{800 W) are varied and the corresponding effect on the breakdown parameters is studied. The experimental results obtained are presented in this paper.

  10. Novel high-affinity and selective biaromatic 4-substituted gamma-hydroxybutyric acid (GHB) analogues as GHB ligands: design, synthesis, and binding studies.

    Science.gov (United States)

    Høg, Signe; Wellendorph, Petrine; Nielsen, Birgitte; Frydenvang, Karla; Dahl, Ivar F; Bräuner-Osborne, Hans; Brehm, Lotte; Frølund, Bente; Clausen, Rasmus P

    2008-12-25

    Gamma-hydroxybutyrate (GHB) is a metabolite of gamma-aminobutyric acid (GABA) and has been proposed to function as a neurotransmitter or neuromodulator. GHB is used in the treatment of narcolepsy and is a drug of abuse. GHB binds to both GABA(B) receptors and specific high-affinity GHB sites in brain, of which the latter have not been linked unequivocally to function, but are speculated to be GHB receptors. In this study, a series of biaromatic 4-substituted GHB analogues, including 4'-phenethylphenyl, 4'-styrylphenyl, and 4'-benzyloxyphenyl GHB analogues, were synthesized and characterized pharmacologically in a [3H](E,RS)-(6,7,8,9-tetrahydro-5-hydroxy-5H-benzocyclohept-6-ylidene)acetic acid ([3H]NCS-382) binding assay and in GABA(A) and GABA(B) receptor binding assays. The compounds were selective for the high-affinity GHB binding sites and several displayed Ki values below 100 nM. The affinity of the 4-[4'-(2-iodobenzyloxy)phenyl] GHB analogue 17b was shown to reside predominantly with the R-enantiomer (Ki = 22 nM), which has higher affinity than previously reported GHB ligands.

  11. Gamma-ray characterization of uranium-series nuclides and its application to the study of the Pena Blanca natural analogue site, Chihuahua, Mexico

    Science.gov (United States)

    Wong, Virgina

    east-west fracture shares this mobility trend. The enrichment event is modeled as a single-stage Ra and U precipitation event. Activity results from surface samples collected from Analogue II strengthen the mobility trends documented from Analogue I. Isotopic data reveal leaching of U and Ra from the stockpile into the alluvium and bedrock. Thorium, on the other hand, has not experienced mobility. Lead exhibits variable mobility behavior. Correlation of isotope data with mineralogy indicates that the Fe-oxyhydroxide and clay minerals appear to be excellent scavengers of U. This observation has been documented in other natural analogue studies, for example, the Oklo natural reactor, the Pocos de Caldas Natural Analogue Project, the Koongarra U Deposit, and the Shinkolobwe U Deposit.

  12. Nitrenium ions and trivalent boron ligands as analogues of N-heterocyclic carbenes in olefin metathesis: a computational study.

    Science.gov (United States)

    Pazio, A; Woźniak, K; Grela, K; Trzaskowski, B

    2015-12-14

    We used the density functional theory to evaluate the suitability of nitrenium ions and trivalent boron ligands as analogues of N-heterocyclic carbenes in ruthenium-based metathesis catalysts. We demonstrate that these analogues induce only minor structural changes in Hoveyda-Grubbs-like precatalysts, but have major impact on precatalyst initiation. Nitrenium ion-modified precatalysts are characterized by a weak Ru-N bond resulting in a relatively strong Ru-O bond and large free energy barriers for initiation, making them good candidates for efficient latent Ru-based catalysts. On the other hand the trivalent boron ligand, bearing a formal -1 charge, binds strongly to the ruthenium ion, weakening the Ru-O bond and facilitating its dissociation, to promote fast reaction initiation. We show that the calculated bond dissociation energy of the Ru-C/N/B bond may serve as an accurate indicator of the Ru-O bond strength and the rate of metathesis initiation.

  13. In-situ electron paramagnetic resonance studies of paramagnetic point defects in superconducting microwave resonators

    Science.gov (United States)

    Zhang, Shengke; Kopas, Cameron; Wagner, Brian; Queen, Daniel; Newman, N.

    2016-09-01

    The physical nature and concentration of paramagnetic point defects in the dielectrics of superconducting planar microwave resonators have been determined using in-situ electron paramagnetic resonance spectroscopy. To perform this work, the quality factor of parallel plate and stripline resonators was measured as a function of the magnitude of a magnetic-field applied parallel to the electrode surfaces. YBa2Cu3O7-δ thin film electrodes proved to be a preferred choice over Nb and MgB2 because they are readily available and have a small surface resistance (Rs) up to high temperatures (˜77 K) and magnetic fields (i.e., dielectric, Co2+-doped Ba(Zn1/3Nb2/3)O3, are shown to have losses dominated by d-electron spin-excitations in exchange-coupled Co2+ point-defect clusters, even in the absence of an applied magnetic field. A significant enhanced microwave loss in stripline and parallel plate resonators is found to correlate with the presence of paramagnetic Mn2+ dopants in Ba(Zn1/3Ta2/3)O3 ceramics and dangling bond states in amorphous Si thin films, although the identification of the dominant loss mechanism(s) in these dielectrics requires further investigation.

  14. Thermal History of Archaeological Objects, Studied by Electron Spin Resonance

    Science.gov (United States)

    Bartoll, Jens; Tani, Atsushi

    Electron spin resonance (ESR) spectroscopy is a sensitive tool for distinguishing between "burned" and "unburned" states of archaeological objects. Prehistoric heating conditions, such as the temperature, atmosphere, time of exposure to heat, and when the heating took place, can be studied by this method with some success. ESR "reporters," such as (a) radiation defects, (b) pyrolytic defects, and (c) transition metal ions, can even reflect changes induced at relatively low temperatures (e.g., in the range of 200° C for objects containing organic compounds). Several ESR heating markers are so stable that samples dating back to the ages when fire first began to be used can be analyzed today. An overview is presented of the literature concerning objects, such as stone, soil, pottery, and plant and animal products.

  15. Effect of gambierol and its tetracyclic and heptacyclic analogues in cultured cerebellar neurons: a structure-activity relationships study.

    Science.gov (United States)

    Pérez, Sheila; Vale, Carmen; Alonso, Eva; Fuwa, Haruhiko; Sasaki, Makoto; Konno, Yu; Goto, Tomomi; Suga, Yuto; Vieytes, Mercedes R; Botana, Luis M

    2012-09-17

    The polycyclic ether class of marine natural products has attracted the attention of researchers due to their complex and large chemical structures and diverse biological activities. Gambierol is a marine polycyclic ether toxin, first isolated along with ciguatoxin congeners from the dinoflagellate Gambierdiscus toxicus. The parent compound gambierol and the analogues evaluated in this work share the main crucial elements for biological activity, previously described to be the C28=C29 double bond within the H ring and the unsaturated side chain [Fuwa, H., Kainuma, N., Tachibana, K., Tsukano, C., Satake, M., and Sasaki, M. (2004) Diverted total synthesis and biological evaluation of gambierol analogues: Elucidation of crucial structural elements for potent toxicity. Chem. Eur. J. 10, 4894-4909]. With the aim to gain a deeper understanding of the cellular mechanisms involved in the biological activity of these compounds, we compared its activity in primary cultured neurons. The three compounds inhibited voltage-gated potassium channels (Kv) in a concentration-dependent manner and with similar potency, caused a small inhibition of voltage-gated sodium channels (Nav), and evoked cytosolic calcium oscillations. Moreover, the three compounds elicited a "loss of function" effect on Kv channels at concentrations of 0.1 nM. Additionally, both the tetracyclic and the heptacyclic derivatives of gambierol elicited synchronous calcium oscillations similar to those previously described for gambierol in cultured cerebellar neurons. Neither gambierol nor its tetracyclic derivative elicited cell toxicity, while the heptacyclic analogue caused a time-dependent decrease in cell viability. Neither the tetracyclic nor the heptacyclic analogues of gambierol exhibited lethality in mice after ip injection of 50 or 80 μg/kg of each compound. Altogether, the results presented in this work support an identical mechanism of action for gambierol and its tetracyclic and heptacyclic analogues

  16. Lessons from Natural CO2 Leakage Analogue Site Studies and their Application to Secure CO2 Storage and Monitoring

    Science.gov (United States)

    Han, W.; McPherson, B. J.; Kim, K.; Chae, G.; Yum, B.

    2011-12-01

    At CO2 injection sites, CO2 leakage from the storage formation could be catastrophic. CO2 is a highly compressible fluid, typically injected at high pressure and temperature conditions. If this compressed CO2 reaches highly permeable conduits such as faults and fractures, CO2 could leak unabated to other formations (e.g. fresh water aquifers) and/or to the surface. Assuming a fast-flow path to the surface, CO2 escaping from the storage formation instantaneously reaches the surface while experiencing adiabatic expansion, which results in Joule-Thomson cooling. The addressed eruptive mechanisms are analogues to natural CO2 eruption mechanisms, which are found in CO2-driven cold-water geysers around the world. A notable example of a CO2-driven cold-water geyser is the Crystal Geyser in central Utah. The fluid mechanics of this regularly erupting geyser was investigated by instrumenting its conduit with pressure, temperature, pH, EC, and dissolved oxygen sensors, measuring every 1 minute during and between eruptions. Results of these measurements suggest that the time-scale of a single-eruption cycle is composed of four successive eruption types with two recharge periods ranging from 30 to 40 hours. Current eruption patterns exhibit a bimodal distribution although previous measurements and anecdotal evidence suggests that this pattern was different prior to recent seismic activity. This cold geyser's eruptions are regular and predictable, and reflect pressure, temperature, EC, pH, and dissolved oxygen changes resulting from Joule-Thomson cooling, endothermic CO2 exsolution, and exothermic CO2 dissolution. Specifically, the perturbation of pressure and temperature data observed at the Crystal Geyser suggested the possibility of using temperature sensing technology within the observation well at the engineered CO2 sequestration site. With the lessons learned from the Crystal Geyser studies, we established the theoretical framework of temperature changes caused by CO2

  17. Recent outputs of the Oklo (Gabon) natural analogue study to nuclear waste disposal; Apports recents de l'etude de l'analogue naturel Oklo (Gabon) dans le domaine du stockage des dechets nucleaires

    Energy Technology Data Exchange (ETDEWEB)

    Michaud, V.; Trotignon, L. [CEA Cadarache, Dept. d' Entreposage et de Stockage des Dechets (DCC/DESD/SESD), 13 - Saint-Paul-lez-Durance (France); Louvat, D. [CEA Cadarache, (IPSN/DPRE/SERNAT/LERCM), 13 - Saint-Paul-lez-Durance (France)

    2000-07-01

    In the past twenty five years, the natural nuclear reactors of Oklo have been the subject of numerous detailed studies. First investigated for the physical and neutron aspects of the nuclear reaction, they were then reconsidered because they provide a unique opportunity in the world to study the containment of actinides and fission products in a geological formation over a broad timescale (two billion years). Although the sites investigated do not represent a complete analogue of a repository system, many of the processes studied (mass transfer to the surface, transport, migration / retention), the spatial extent of these processes, and the timescales involved, are compatible with processes liable to occur during the lifespan of a repository for the deep geological disposal of spent nuclear fuel. A fresh program was therefore initiated as a European Commission project in 1990, entitled''Oklo as a natural analog for transfer processes in a radioactive waste repository'- phase 7, and then extended by a phase 2 entitled Oklo, Natural Analogue - Behavior of Nuclear Reaction Products in a Natural Environment''. Researches conducted in phase I served to determine the physical conditions of the operation of the natural reactor, reconstruct the geological history of the reactor environment, and decode the behavior of actinides as well as fission products in the surrounding geological formations. Phase N, which ended in June 1999, had three main objectives: i) to assess radionuclide migration and retention processes from the reactor zones to the geological environment, ii) to define the confinement properties and long-term behavior of geological materials; iii) to test models of processes related to radionuclide migration and retention, and eventually to provide suitable data and scenarios for performance assessment of nuclear waste disposal. This paper proposes a synthesis of the main outputs of the Oklo project to the performance assessment of

  18. Study of lone working magnetic resonance technologists in Western Australia

    Directory of Open Access Journals (Sweden)

    Tracy Anne Dewland

    2013-12-01

    Full Text Available Objectives: It is recommended that magnetic resonance (MR technologists should not work alone due to potential occupational health risks although lone working is legally acceptable. The objective of this study was to investigate the current situation of lone working MR technologists in Western Australia (WA and any issue against the regulations. Materials and Methods: A questionnaire regarding the issues of occupational health of lone working MR technologists was developed based on relevant literature and distributed to WA MR technologists. Descriptive (percentage of frequency, mean and standard deviation and inferential statistics (Fisher's exact, Chi2 and t tests, and analysis of variance were used to analyze the responses of the yes/no, multiple choice and 5 pt scale questions from the returned questionnaires. Results: The questionnaire response rate was 65.6% (59/90. It was found that about half of the MR technologists (45.8%, 27/59 experienced lone working. The private magnetic resonance imaging (MRI centers were more likely to arrange technologists to work alone (p < 0.05. The respondents expressed positive views on issues of adequacy of training and arrangement, confidence and comfort towards lone working except immediate assistance for emergency (mean: 3. Factors of existence of MRI safety officer (p < 0.05 and nature of lone working (p < 0.001-0.05 affected MR technologists' concerns. Conclusions: Lone working of MR technologists is common in WA especially in private centers. The training and arrangement provided seem to be adequate for meeting the legal requirements. However, several areas should be improved by the workplaces including enhancement on immediate emergency assistance and concern relief.

  19. Synthesis of Tonghaosu Analogues

    Institute of Scientific and Technical Information of China (English)

    SUN Hai; LIN Yingjie; WU Yulin; WU Yikang

    2009-01-01

    Several new analogues of natural antifeedant tonghaosu were synthesized via m-CPBA (m-chloroperoxybenzoic acid) oxidation of corresponding 3-(a-furyl)propanols, Luche reduction of the resulting enone, epoxidation, acid-mediated spiroketalization, and radical mediated dehydration.

  20. Studies of Beam Induced Electron Cloud Resonances in Dipole Magnetic Fields

    CERN Document Server

    Calvey, J R; Makita, J; Venturini, M

    2016-01-01

    The buildup of low energy electrons in an accelerator, known as electron cloud, can be severely detrimental to machine performance. Under certain beam conditions, the beam can become resonant with the cloud dynamics, accelerating the buildup of electrons. This paper will examine two such effects: multipacting resonances, in which the cloud development time is resonant with the bunch spacing, and cyclotron resonances, in which the cyclotron period of electrons in a magnetic field is a multiple of bunch spacing. Both resonances have been studied directly in dipole fields using retarding field analyzers installed in the Cornell Electron Storage Ring (CESR). These measurements are supported by both analytical models and computer simulations.

  1. A prospective randomised cross-over study of the effect of insulin analogues and human insulin on the frequency of severe hypoglycaemia in patients with type 1 diabetes and recurrent hypoglycaemia (the HypoAna trial)

    DEFF Research Database (Denmark)

    Kristensen, Peter Lommer; Pedersen-Bjergaard, Uirik; Beck-Nielsen, Henning

    2012-01-01

    of insulin analogues on glycaemic control has been documented in large trials, while their effect on the frequency of severe hypoglycaemia is less clear, especially in patients with recurrent severe hypoglycaemia. The HypoAna Trial is designed to investigate whether short-acting and long-acting insulin...... analogues in comparison with human insulin are superior in reducing the occurrence of severe hypoglycaemic episodes in patients with recurrent hypoglycaemia. This paper reports the study design of the HypoAna Trial....

  2. Bradykinin and its gly sup 6 analogue are substrates of cyclophilin: A fluorine-19 magnetization transfer study

    Energy Technology Data Exchange (ETDEWEB)

    London, R.E.; Davis, D.G. (NIEHS, NC (USA)); Vavrek, R.J.; Stewart, J.M. (Univ. of Colorado Health Sciences Center, Denver, CO (USA)); Handschumacher, R.E. (Yale Univ., New Haven, CT (USA))

    1990-11-01

    Fluorine-19 magnetization transfer experiments have been used to determine the rates of cis/trans isomerization about the X-Pro{sup 7} peptide bond in (p-fluoro-Phe{sup 8})bradykinin and its Gly{sup 6} analogue. The measurements were carried out both prior to and after the addition of cyclophilin, which has recently been shown to have peptidyl-proline cis/trans isomerase activity and is the apparent target enzyme of the immunosuppressive agent cyclosporin A. Magnetization transfer measurements over the temperature range 40-75 {degree}C in the absence of enzyme give activation energies of 22.8 and 23.0 kcal/mol for (p-fluoro-Phe{sup 8})bradykinin and its Gly{sup 6} analogue, respectively. The values for the uncatalyzed cis {r arrow} trans rate constant, k{sub c}, are determined by extrapolation to be 4.8 {times} 10{sup {minus}2} and 2.1 {times} 10{sup {minus}2} s{sup {minus}1} for the two peptides at 25 {degree}C. The enzyme-catalyzed enhancement of the cis/trans interconversion rate was proportional to added cyclophilin concentration and was strongly sequence specific, with bradykinin a much better substrate than (Gly{sup 6})bradykinin. At a peptide concentration of 2.2 mM, the catalytic activity expressed as k{sub c} per micromolar cyclophilin was determined to be 1.2 s{sup {minus}1}/{mu}M for (p-fluoro-Phe{sup 8})bradykinin and 0.13 s{sup {minus}1}/{mu}M for the Gly{sup 6}analogue. The increased cis {r arrow} trans interconversion rates were strongly inhibited by cyclosporin A and the 6-(methylalanine) derivative, which bind to cyclophilin, but not by the 1-(tetrahydrofurfuryl) derivative of cyclosporin that binds weakly.

  3. Glucagon-like peptide-1 analogue therapy for psoriasis patients with obesity and type 2 diabetes: a prospective cohort study.

    LENUS (Irish Health Repository)

    Ahern, T

    2012-06-13

    Background  Diabetes and obesity are more prevalent amongst psoriasis patients as is disturbance of the innate immune system. GLP-1 analogue therapy considerably improves weight and glycaemic control in people with type 2 diabetes and its receptor is present on innate immune cells. Objective  We aimed to determine the effect of liraglutide, a GLP-1 analogue, on psoriasis severity. Methods  Before and after 10 weeks of liraglutide therapy (1.2 mg subcutaneously daily) we determined the psoriasis area and severity index (PASI) and the dermatology life quality index (DLQI) in seven people with both psoriasis and diabetes (median age 48 years, median body mass index 48.2 kg\\/m(2) ). We also evaluated the immunomodulatory properties of liraglutide by measuring circulating lymphocyte subset numbers and monocyte cytokine production. Results  Liraglutide therapy decreased the median PASI from 4.8 to 3.0 (P = 0.03) and the median DLQI from 6.0 to 2.0 (P = 0.03). Weight and glycaemic control improved significantly. Circulating invariant natural killer T (iNKT) cells increased from 0.13% of T lymphocytes to 0.40% (P = 0.03). Liraglutide therapy also effected a non-significant 54% decrease in the proportion of circulating monocytes that produced tumour necrosis factor alpha (P = 0.07). Conclusion  GLP-1 analogue therapy improves psoriasis severity, increases circulating iNKT cell number and modulates monocyte cytokine secretion. These effects may result from improvements in weight and glycaemic control as well as from direct immune effects of GLP-1 receptor activation. Prospective controlled trials of GLP-1 therapies are warranted, across all weight groups, in psoriasis patients with and without type 2 diabetes.

  4. A New View on Interstellar Dust - High Fidelity Studies of Interstellar Dust Analogue Tracks in Stardust Flight Spare Aerogel

    Science.gov (United States)

    Zolensky, Michael E.; Postberg F.; Allen, C.; Bajt, S.; Bechtel, H. A.; Borg, J.; Brenker, F.; Bridges, J.; Brownlee, D. E.; Bugiel, S.; Burchell, M.; Burghammer, M.; Butterworth, A. L.; Cloetens, P.; Davis, A. M.; Floss, C.; Flynn, G. J.; Frank, D.; Gainsforth, Z.

    2011-01-01

    In 2000 and 2002 the Stardust Mission exposed aerogel collector panels for a total of about 200 days to the stream of interstellar grains sweeping through the solar system. The material was brought back to Earth in 2006. The goal of this work is the laboratory calibration of the collection process by shooting high speed [5 - 30km/s] interstellar dust (ISD) analogues onto Stardust aerogel flight spares. This enables an investigation into both the morphology of impact tracks as well as any structural and chemical modification of projectile and collector material. First results indicate a different ISD flux than previously assumed for the Stardust collection period.

  5. Complex of Burkholderia cepacia lipase with transition state analogue of 1-phenoxy-2-acetoxybutane: biocatalytic, structural and modelling study.

    Science.gov (United States)

    Luić, M; Tomić, S; Lescić, I; Ljubović, E; Sepac, D; Sunjić, V; Vitale, L; Saenger, W; Kojic-Prodić, B

    2001-07-01

    In a series of four racemic phenoxyalkyl-alkyl carbinols, 1-phenoxy-2-hydroxybutane (1) is enantioselectively acetylated by Burkholderia cepacia (formerly Pseudomonas cepacia) lipase with an E value > or = 200, whereas for the other three racemates E was found to be analogue with a tetrahedral P-atom, (R(P),S(P))-O-(2R)-(1-phenoxybut-2-yl)methylphosphonic acid chloride was prepared and crystallized in complex with B. cepacia lipase. The X-ray structure of the complex was determined, allowing to compare the conformation of the inhibitor with results of molecular modelling.

  6. A Study of Electromagnetic Transition of △(1232) Resonance

    Institute of Scientific and Technical Information of China (English)

    DONG Yu-Bing; LIU Jian

    2004-01-01

    Point form relativistic dynamics of relativistic quantum mechanics is employed to estimate the photon and electroproduction amplitudes of △(1232) resonance. Results are compared with the non-relativistic work, and the differences between the two frame works are discussed.

  7. Studies of Nucleon Resonance Structure in Exclusive Meson Electroproduction

    CERN Document Server

    Aznauryan, I G; Braun, V; Brodsky, S J; Burkert, V D; Chang, L; Chen, Ch; El-Bennich, B; Cloët, I C; Cole, P L; Edwards, R G; Fedotov, G V; Giannini, M M; Gothe, R W; Lin, Huey-Wen; Kroll, P; Lee, T -S H; Melnitchouk, W; Mokeev, V I; Peña, M T; Ramalho, G; Roberts, C D; Santopinto, E; de Teramond, G F; Tsushima, K; Wilson, D J

    2013-01-01

    Studies of the structure of excited baryons are key to the N* program at Jefferson Lab. Within the first year of data taking with the Hall B CLAS12 detector following the 12 GeV upgrade, a dedicated experiment will aim to extract the N* electrocouplings at high photon virtualities Q2. This experiment will allow exploration of the structure of N* resonances at the highest photon virtualities ever yet achieved, with a kinematic reach up to Q2 = 12 GeV2. This high-Q2 reach will make it possible to probe the excited nucleon structures at distance scales ranging from where effective degrees of freedom, such as constituent quarks, are dominant through the transition to where nearly massless bare-quark degrees of freedom are relevant. In this document, we present a detailed description of the physics that can be addressed through N* structure studies in exclusive meson electroproduction. The discussion includes recent advances in reaction theory for extracting N* electrocouplings from meson electroproduction off pro...

  8. Theoretical Study of Pd11 Si6 Nanosheet Compounds Including Seven-Coordinated Si Species and Its Ge Analogues.

    Science.gov (United States)

    Chen, Yue; Sunada, Yusuke; Nagashima, Hideo; Sakaki, Shigeyoshi

    2016-01-18

    Nanosheet compounds Pd11 (SiiPr)2 (SiiPr2 )4 (CNtBu)10 (1) and Pd11 (SiiPr)2 (SiiPr2 )4 (CNMes)10 (2), containing two Pd7 (SiiPr)(SiiPr2 )2 (CNR)4 plates (R=tBu or Mes) connected with three common Pd atoms, were investigated with DFT method. All Pd atoms are somewhat positively charged and the electron density is accumulated between the Pd and Si atoms, indicating that a charge transfer (CT) occurs from the Pd to the Si atoms of the SiMe2 and SiMe groups. Negative regions of the Laplacian of the electron density were found between the Pd and Si atoms. A model of a seven-coordinated Si species, that is, Pd5 (Pd-SiMe), is predicted to be a stable pentagonal bipyramidal molecule. Five Pd atoms in the equatorial plane form bonding overlaps with two 3p orbitals of the Si atom. This is a new type of hypervalency. The Ge analogues have geometry and an electronic structure similar to those of the Si compounds. But their formation energies are smaller than those of the Si analogues. The use of the element Si is crucial to synthesize these nanoplate compounds.

  9. Novel nuclear magnetic resonance techniques for studying biological molecules

    Energy Technology Data Exchange (ETDEWEB)

    Laws, David D.

    2000-06-01

    Over the fifty-five year history of Nuclear Magnetic Resonance (NMR), considerable progress has been made in the development of techniques for studying the structure, function, and dynamics of biological molecules. The majority of this research has involved the development of multi-dimensional NMR experiments for studying molecules in solution, although in recent years a number of groups have begun to explore NMR methods for studying biological systems in the solid-state. Despite this new effort, a need still exists for the development of techniques that improve sensitivity, maximize information, and take advantage of all the NMR interactions available in biological molecules. In this dissertation, a variety of novel NMR techniques for studying biomolecules are discussed. A method for determining backbone ({phi}/{psi}) dihedral angles by comparing experimentally determined {sup 13}C{sub a}, chemical-shift anisotropies with theoretical calculations is presented, along with a brief description of the theory behind chemical-shift computation in proteins and peptides. The utility of the Spin-Polarization Induced Nuclear Overhauser Effect (SPINOE) to selectively enhance NMR signals in solution is examined in a variety of systems, as are methods for extracting structural information from cross-relaxation rates that can be measured in SPINOE experiments. Techniques for the production of supercritical and liquid laser-polarized xenon are discussed, as well as the prospects for using optically pumped xenon as a polarizing solvent. In addition, a detailed study of the structure of PrP 89-143 is presented. PrP 89-143 is a 54 residue fragment of the prion proteins which, upon mutation and aggregation, can induce prion diseases in transgenic mice. Whereas the structure of the wild-type PrP 89-143 is a generally unstructured mixture of {alpha}-helical and {beta}-sheet conformers in the solid state, the aggregates formed from the PrP 89-143 mutants appear to be mostly {beta}-sheet.

  10. Performance of the Visual Analogue Scale of Happiness and of the Cornell Scale for Depression in Dementia in the Tremembé Epidemiological Study, Brazil

    Directory of Open Access Journals (Sweden)

    Karolina G. César

    Full Text Available Depression is a major growing public health problem. Many population studies have found a significant relationship between depression and the presence of cognitive disorders. OBJECTIVE: To establish the correlation between the Visual Analogue Scale of Happiness and the Cornell Scale for Depression in Dementia in the population aged 60 years or over in the city of Tremembé, state of São Paulo, Brazil. METHODS: An epidemiological survey involving home visits was carried out in the city of Tremembé. The sample was randomly selected by drawing 20% of the population aged 60 years or older from each of the city's census sectors. In this single-phase study, the assessment included clinical history, physical and neurological examination, cognitive evaluation, and application of both the Cornell Scale and the Analogue Scale of Happiness for psychiatric symptoms. The presence of depressive symptoms was defined as scores greater than or equal to 8 points on the Cornell Scale. RESULTS: A total of 623 subjects were evaluated and of these 251 (40.3% had clinically significant depressive symptoms on the Cornell Scale, with a significant association with female gender (p<0.001 and with lower education (p=0.012. One hundred and thirty-six participants (21.8% chose the unhappiness faces, with a significant association with age (p<0.001, female gender (p=0.020 and low socioeconomic status (p=0.012. Although there was a statistically significant association on the correlation test, the correlation was not high (rho=0.47. CONCLUSION: The prevalence of depressive symptoms was high in this sample and the Visual Analogue Scale of Happiness and Cornell Scale for Depression in Dementia should not be used as similar alternatives for evaluating the presence of depressive symptoms, at least in populations with low educational level.

  11. Recent advances in biosynthetic modeling of nitric oxide reductases and insights gained from nuclear resonance vibrational and other spectroscopic studies

    Energy Technology Data Exchange (ETDEWEB)

    Chakraborty, Saumen; Reed, Julian; Sage, Timothy; Branagan, Nicole C.; Petrik, Igor D.; Miner, Kyle D.; Hu, Michael Y.; Zhao, Jiyong; Alp, E. Ercan; Lu, Yi

    2015-10-05

    This Forum Article focuses on recent advances in structural and spectroscopic studies of biosynthetic models of nitric oxide reductases (NORs). NORs are complex metalloenzymes found in the denitrification pathway of Earth's nitrogen cycle where they catalyze the proton-dependent twoelectron reduction of nitric oxide (NO) to nitrous oxide (N2O). While much progress has been made in biochemical and biophysical studies of native NORs and their variants, a. clear mechanistic understanding of this important metalloenzyme related to its function is still elusive. We report herein UV vis and nuclear resonance vibrational spectroscopy (NRVS) studies of mononitrosylated intermediates of the NOR reaction of a biosynthetic model. The ability to selectively substitute metals at either heme or nonheme metal sites allows the introduction of independent 57Fe probe atoms at either site, as well as allowing the preparation of analogues of stable reaction intermediates by replacing either metal with a redox inactive metal. Together with previous structural and spectroscopic results, we summarize insights gained from studying these biosynthetic models toward understanding structural features responsible for the NOR activity and its mechanism. As a result, the outlook on NOR modeling is also discussed, with an emphasis on the design of models capable of catalytic turnovers designed based on close mimics of the secondary coordination sphere of native NORs.

  12. 3D structure of a heparin mimetic analogue of a FGF-1 activator. A NMR and molecular modelling study.

    Science.gov (United States)

    Muñoz-García, Juan C; Solera, Cristina; Carrero, Paula; de Paz, José L; Angulo, Jesús; Nieto, Pedro M

    2013-12-21

    The motional behaviour of heparin oligosaccharides in solution is best described as a top rotor having two perpendicular rotation axes. This prevents an accurate extraction of interprotonic distances by NOESY/ROESY based methods. In this paper, we describe the solution structure of the hexasaccharide 1 calculated from high exactitude distance data obtained from off-resonance ROESY combined with a long MD simulation of 500 ns. In previous studies, we have found that two synthetic hexasaccharides having the sulphate groups directed towards one side of its central plane have an opposite biological activity, while 1 is unable to activate the FGF-1 signalling pathway, the other (2) is even more active than the regular region derived hexasaccharide (3) that mimics the natural active compound, heparin. From the structural analysis it was concluded that 1 has similar three-dimensional characteristics to 2 or 3 and therefore the differences in the activity should be due to the arrangement of the sulphate groups within the hexasaccharidic sequence.

  13. Study of proton resonances in 18Ne via resonant elastic scattering of 17F+p and its astrophysical implication

    Institute of Scientific and Technical Information of China (English)

    2011-01-01

    The proton resonant properties in 18Ne, which determine the reaction rate of the key stellar 14O(α,p)17F reaction, have been studied by using a technique of proton resonant elastic scattering of 17F+p. A 4.22 MeV/nucleon 17F radioactive ion (RI) beam was produced via a projectile-fragmentation reaction, and separated by a Radioactive Ion Beam Line in Lanzhou (RIBLL). By bombarding a thick (CH2)n target, the energy spectra of the recoiled protons were measured by two ΔE-E silicon telescopes at the center-of-mass scattering angles of θc.m.≈175°±5°, θc.m.≈152°±8°, respectively. Several proton resonances in 18Ne were ob served clearly. A further R-matrix analysis of the experimental data is under way to determine the resonant parameters. The present work reports the preliminary results briefly.

  14. RESPECT: Neutron Resonance Spin-Echo Spectrometer for Extreme Studies

    CERN Document Server

    Georgii, Robert; Pfleiderer, Christian; Böni, Peter

    2016-01-01

    We propose the design of a Resonance SPin-echo spECtrometer for exTreme studies, RESPECT, that is ideally suited for the exploration of non-dispersive processes such as diffusion, crystallization, slow dynamics, tunneling processes, crystal electric field excitations, and spin fluctuations. It is a variant of the conventional neutron spin-echo technique (NSE) by i) replacing the long precession coils by pairs of longitudinal neutron spin-echo coils combined with RF-spin flippers and ii) by stabilizing the neutron polarization with small longitudinal guide fields that can in addition be used as field subtraction coils thus allowing to adjust the field integrals over a range of 8 orders of magnitude. Therefore, the dynamic range of RESPECT can in principle be varied over 8 orders of magnitude in time, if neutrons with the required energy are made available. Similarly as for existing NSE-spectrometers, spin echo times of up to approximately 1 microsecond can be reached if the divergence and the correction elemen...

  15. Functional magnetic resonance imaging study of writer's cramp

    Institute of Scientific and Technical Information of China (English)

    HU Xing-yue; WANG Li; LIU Hai; ZHANG Shi-zheng

    2006-01-01

    Background Writer's cramp is a type of task specific idiopathic focal dystonia and has an incompletelyunderstood pathophysiology. The present study utilized functional magnetic resonance imaging (fMRI) toinvestigate what type of brain activity correlates with writer's cramp and its physiological mechanism.Methods Ten patients with writer's cramp were age and gender matched with ten healthy control subjects in ablock design. Subjects were scanned by fMRI while performing three consecutive, visually instructive, tasks withMR Vision 2000: (1) suppositional writing, (2) writing with finger and (3) writing with a pencil. Data wasanalysed using AFNI software for groups of patients and controls.Results The patients with writer's cramp showed significant activations of contralateral basal ganglion(especially the putamen), motor cortex (primary sensorimotor cortex, supplementary motor cortex, premotorcortex) and ipsilateral cerebellar hemisphere in writing with a pencil compared with controls; whereas there wasno obvious difference between patients and controls during writing with finger. Furthermore, these differencesexist in the subtractive activated maps for "writing with a pencil" minus "writing with finger" of patients, whenthe activation of subcortical area and insula in controls disappeared.Conclusions Abnormal activations of contralateral basal ganglion, motor cortex and ipsilateral cerebellarhemisphere of the patients with writer's cramp suggest dysfunction of basal ganglion and subcortical-corticalloop might play a pathophysiological role in writer's cramp.

  16. Impact of GnRH analogues on oocyte/embryo quality and embryo development in in vitro fertilization/intracytoplasmic sperm injection cycles: a case control study

    Directory of Open Access Journals (Sweden)

    Rigó János

    2009-09-01

    Full Text Available Abstract Background Despite the clinical outcomes of ovarian stimulation with either GnRH-agonist or GnRH-antagonist analogues for in vitro fertilization (IVF being well analysed, the effect of analogues on oocyte/embryo quality and embryo development is still not known in detail. The aim of this case-control study was to compare the efficacy of a multiple-dose GnRH antagonist protocol with that of the GnRH agonist long protocol with a view to oocyte and embryo quality, embryo development and IVF treatment outcome. Methods Between October 2001 and December 2008, 100 patients were stimulated with human menopausal gonadotrophin (HMG and GnRH antagonist in their first treatment cycle for IVF or intracytoplasmic sperm injection (ICSI. One hundred combined GnRH agonist + HMG (long protocol cycles were matched to the GnRH antagonist + HMG cycles by age, BMI, baseline FSH levels and by cause of infertility. We determined the number and quality of retrieved oocytes, the rate of early-cleavage embryos, the morphology and development of embryos, as well as clinical pregnancy rates. Statistical analysis was performed using Wilcoxon's matched pairs rank sum test and McNemar's chi-square test. P Results The rate of cytoplasmic abnormalities in retrieved oocytes was significantly higher with the use of GnRH antagonist than in GnRH agonist cycles (62.1% vs. 49.9%; P Conclusion Antagonist seemed to influence favourably some parameters of early embryo development dynamics, while other morphological parameters seemed not to be altered according to GnRH analogue used for ovarian stimulation in IVF cycles.

  17. Immediate, non-submerged, root-analogue direct laser metal sintering (DLMS) implants: a 1-year prospective study on 15 patients.

    Science.gov (United States)

    Mangano, Francesco Guido; De Franco, Michele; Caprioglio, Alberto; Macchi, Aldo; Piattelli, Adriano; Mangano, Carlo

    2014-07-01

    This study evaluated the 1-year survival and success rate of root-analogue direct laser metal sintering (DLMS) implants, placed into the extraction sockets of 15 patients. DLMS is a technology which allows solids with complex geometry to be fabricated by annealing metal powder microparticles in a focused laser beam, according to a computer-generated three-dimensional (3D) model; the fabrication process involves the laser-induced fusion of titanium microparticles, in order to build, layer-by-layer, the desired object. Cone-beam computed tomography (CBCT) acquisition and 3D image conversion, combined with the DLMS process, allow the fabrication of custom-made, root-analogue implants (RAIs). CBCT images of 15 non-restorable premolars (eight maxilla; seven mandible) were acquired and transformed into 3D models: from these, custom-made, root-analogue DLMS implants with integral abutment were fabricated. Immediately after tooth extraction, the RAIs were placed in the sockets and restored with a single crown. One year after implant placement, clinical and radiographic parameters were assessed: success criteria included absence of pain, suppuration, and exudation; absence of implant mobility and absence of continuous peri-implant radiolucency; distance between the implant shoulder and the first visible bone-to-implant contact implants were lost, for a survival rate of 100 %. All implants were stable, with no signs of infection. The good conditions of the peri-implant tissues were confirmed by the radiographic examination, with a mean DIB of 0.7 mm (±0.2). The possibility of fabricating custom-made, RAI DLMS implants opens new interesting horizons for immediate placement of dental implants.

  18. Proton nuclear magnetic resonance studies on the variant-3 neurotoxin from Centruroides sculpturatus Ewing: Sequential assignment of resonances

    Energy Technology Data Exchange (ETDEWEB)

    Nettesheim, D.G.; Klevit, R.E.; Drobny, G.; Watt, D.D.; Krishna, N.R. (Univ. of Alabama, Birmingham (USA))

    1989-02-21

    The authors report the sequential assignment of resonances to specific residues in the proton nuclear magnetic resonance spectrum of the variant-3 neurotoxin from the scorpion Centruroides sculpturatus Ewing (range southwestern U.S.A.). A combination of two-dimensional NMR experiments such as 2D-COSY, 2D-NOESY, and single- and double-RELAY coherence transfer spectroscopy has been employed on samples of the protein dissolved in D{sub 2}O and in H{sub 2}O for assignment purposes. These studies provide a basis for the determination of the solution-phase conformation of this protein and for undertaking detailed structure-function studies of these neurotoxins that modulate the flow of sodium current by binding to the sodium channels of excitable membranes.

  19. Study of the onset of the acoustic streaming in parallel plate resonators with pulse ultrasound.

    Science.gov (United States)

    Castro, Angelica; Hoyos, Mauricio

    2016-03-01

    In a previous study, we introduced pulse mode ultrasound as a new method for reducing and controlling the acoustic streaming in parallel plate resonators (Hoyos and Castro, 2013). Here, by modifying other parameters such as the resonator geometry and the particle size, we have found a threshold for particle manipulation with ultrasonic standing waves in confined resonators without the influence of the acoustic streaming. We demonstrate that pulse mode ultrasound open the possibility of manipulating particles smaller than 1 μm size.

  20. Experimental DNA-binding and computer modelling studies on an analogue of the anti-tumor drug amsacrine.

    Science.gov (United States)

    Abraham, Z H; Agbandje, M; Neidle, S; Acheson, R M

    1988-12-01

    The DNA-binding properties of the anti-cancer drug amsacrine and a 9-aminoacridine analogue substituted at the 4 position with a 4-methanesulphonanilido-group, have been examined by means of unwinding, melting and equilibrium binding experiments. These find that the latter compound is at least as effective as a DNA-binder and intercalator as amsacrine itself. Molecular modelling and energetic calculations have confirmed this, and have produced plausible intercalation geometries. These show that there are subtle differences in the low-energy minor groove arrangements adopted by the substituents of the two drugs. Speculation is advanced that these differences may be relevant to the marked differences in cytotoxicity shown by the two compounds.

  1. An analogue study of the effects of asian cultural values and counselor multicultural competence on counseling process.

    Science.gov (United States)

    Li, Lisa C; Kim, Bryan S K; O'Brien, Karen M

    2007-03-01

    One-hundred-and-sixteen Asian American college students viewed analogue videotapes in which an actress portraying a European American female "counselor" expressed cultural values that were either consistent or inconsistent with Asian culture to an actress portraying an Asian American female "client." In addition, the counselor either acknowledged racial differences or did not acknowledge racial differences with the client. The results showed that when the counselor expressed values that were inconsistent with Asian culture, the counselor who acknowledged racial differences was perceived to be more cross-culturally competent than the counselor who did not acknowledge racial differences. Also, the results showed that observer-participants' adherence to the value of conformity to norms was positively associated with their ratings of counselor credibility and crosscultural counseling competence. (PsycINFO Database Record (c) 2010 APA, all rights reserved).

  2. Mössbauer study of a tetrakis (pentafluorophenyl porphyrin iron (III chloride in comparison with the fluorine unsubstituted analogue

    Directory of Open Access Journals (Sweden)

    Kaczmarzyk Tomasz

    2015-03-01

    Full Text Available Mössbauer investigations, in association with density functional theory (DFT calculations, have been conducted for the molecular and electronic structures of iron (III [tetrakis (pentafluorophenyl] porphyrin chloride [(F20TPPFe:Cl], as a Fe(III-tetraphenylporphyrin complex containing chloride axial ligand and substituted hydrogen atoms by fluorine ones in the four phenyl rings, in comparison with its fluorine unsubstituted analogue [(TPPFe:Cl]. It was found that the parameters of Mössbauer spectra of both complexes are close to one another, and correspond to the high-spin state of Fe(III ions, but they show the different temperature dependence and the quadrupole doublets in Mössbauer spectra show different asymmetry at low temperatures. Results of DFT calculations are analyzed in the light of catalytic activity of the halogenated complex.

  3. Unicuspid aortic valve disease: a magnetic resonance imaging study

    Energy Technology Data Exchange (ETDEWEB)

    Debl, K.; Buchner, S.; Heinicke, N.; Riegger, G.; Luchner, A. [Klinik und Poliklinik fuer Innere Medizin II, Universitaetsklinikum Regensburg (Germany); Djavidani, B.; Poschenrieder, F.; Feuerbach, S. [Inst. fuer Roentgendiagnostik, Universitaetsklinikum Regensburg (Germany); Schmid, C.; Kobuch, R. [Klinik und Poliklinik fuer Herz-, Thorax- und herznahe Gefaesschirurgie, Universitaetsklinikum Regensburg (Germany)

    2008-11-15

    Purpose: congenitally malformed aortic valves are a common finding in adults with aortic valve disease. Most of these patients have bicuspid aortic valve disease. Unicuspid aortic valve disease (UAV) is rare. The aim of our study was to describe valve morphology and the dimensions of the proximal aorta in a cohort of 12 patients with UAV in comparison to tricuspid aortic valve disease (TAV) using magnetic resonance imaging (MRI). Materials and methods/results: MRI studies were performed on a 1.5 T scanner in a total of 288 consecutive patients with aortic valve disease. 12 aortic valves were retrospectively classified as UAV. Annulus areas and dimensions of the thoracic aorta were retrospectively compared to a cohort of 103 patients with TAV. In UAV, valve morphology was unicuspid unicommissural with a posterior commissure in all patients. Mean annulus areas and mean diameters of the ascending aorta were significantly greater in UAV compared to TAV (12.6 {+-} 4.7 cm{sup 2} vs. 8.7 {+-} 2.3 cm{sup 2}, p < 0.01 and 4.6 {+-} 0.7 cm vs. 3.6 {+-} 0.5 cm, p < 0.0001, respectively), while no differences were observed in the mean diameters of the aortic arch (2.3 {+-} 0.6 cm vs. 2.3 {+-} 0.4 cm, p = 0.69). The diameters of the descending aorta were slightly smaller in UAV compared to TAV (2.2 {+-} 0.5 cm vs. 2.6 {+-} 0.3 cm, p < 0.05). (orig.)

  4. Isotopically labeled sulfur compounds and synthetic selenium and tellurium analogues to study sulfur metabolism in marine bacteria

    Directory of Open Access Journals (Sweden)

    Nelson L. Brock

    2013-05-01

    Full Text Available Members of the marine Roseobacter clade can degrade dimethylsulfoniopropionate (DMSP via competing pathways releasing either methanethiol (MeSH or dimethyl sulfide (DMS. Deuterium-labeled [2H6]DMSP and the synthetic DMSP analogue dimethyltelluriopropionate (DMTeP were used in feeding experiments with the Roseobacter clade members Phaeobacter gallaeciensis DSM 17395 and Ruegeria pomeroyi DSS-3, and their volatile metabolites were analyzed by closed-loop stripping and solid-phase microextraction coupled to GC–MS. Feeding experiments with [2H6]DMSP resulted in the incorporation of a deuterium label into MeSH and DMS. Knockout of relevant genes from the known DMSP demethylation pathway to MeSH showed in both species a residual production of [2H3]MeSH, suggesting that a second demethylation pathway is active. The role of DMSP degradation pathways for MeSH and DMS formation was further investigated by using the synthetic analogue DMTeP as a probe in feeding experiments with the wild-type strain and knockout mutants. Feeding of DMTeP to the R. pomeroyi knockout mutant resulted in a diminished, but not abolished production of demethylation pathway products. These results further corroborated the proposed second demethylation activity in R. pomeroyi. Isotopically labeled [2H3]methionine and 34SO42−, synthesized from elemental 34S8, were tested to identify alternative sulfur sources besides DMSP for the MeSH production in P. gallaeciensis. Methionine proved to be a viable sulfur source for the MeSH volatiles, whereas incorporation of labeling from sulfate was not observed. Moreover, the utilization of selenite and selenate salts by marine alphaproteobacteria for the production of methylated selenium volatiles was explored and resulted in the production of numerous methaneselenol-derived volatiles via reduction and methylation. The pathway of selenate/selenite reduction, however, proved to be strictly separated from sulfate reduction.

  5. Resonance widths in open microwave cavities studied by harmonic inversion.

    Science.gov (United States)

    Kuhl, U; Höhmann, R; Main, J; Stöckmann, H-J

    2008-06-27

    From the measurement of a reflection spectrum of an open microwave cavity, the poles of the scattering matrix in the complex plane have been determined. The resonances have been extracted by means of the harmonic inversion method. By this, it became possible to resolve the resonances in a regime where the linewidths exceed the mean level spacing up to a factor of 10, a value inaccessible in experiments up to now. The obtained experimental distributions of linewidths were found to be in perfect agreement with predictions from random matrix theory when wall absorption and fluctuations caused by couplings to additional channels are considered.

  6. Resonance widths in open microwave cavities studied by harmonic inversion

    OpenAIRE

    Kuhl, U; Hoehmann, R.; Main, J.; Stoeckmann, H. -J.

    2007-01-01

    From the measurement of a reflection spectrum of an open microwave cavity the poles of the scattering matrix in the complex plane have been determined. The resonances have been extracted by means of the harmonic inversion method. By this it became possible to resolve the resonances in a regime where the line widths exceed the mean level spacing up to a factor of 10, a value inaccessible in experiments up to now. The obtained experimental distributions of line widths were found to be in perfec...

  7. Novel nuclear magnetic resonance techniques for studying biological molecules

    Energy Technology Data Exchange (ETDEWEB)

    Laws, David Douglas [Univ. of California, Berkeley, CA (United States)

    2000-06-01

    Over the fifty-five year history of Nuclear Magnetic Resonance (NMR), considerable progress has been made in the development of techniques for studying the structure, function, and dynamics of biological molecules. The majority of this research has involved the development of multi-dimensional NMR experiments for studying molecules in solution, although in recent years a number of groups have begun to explore NMR methods for studying biological systems in the solid-state. Despite this new effort, a need still exists for the development of techniques that improve sensitivity, maximize information, and take advantage of all the NMR interactions available in biological molecules. In this dissertation, a variety of novel NMR techniques for studying biomolecules are discussed. A method for determining backbone (Φ/Ψ) dihedral angles by comparing experimentally determined 13Ca, chemical-shift anisotropies with theoretical calculations is presented, along with a brief description of the theory behind chemical-shift computation in proteins and peptides. The utility of the Spin-Polarization Induced Nuclear Overhauser Effect (SPINOE) to selectively enhance NMR signals in solution is examined in a variety of systems, as are methods for extracting structural information from cross-relaxation rates that can be measured in SPINOE experiments. Techniques for the production of supercritical and liquid laser-polarized xenon are discussed, as well as the prospects for using optically pumped xenon as a polarizing solvent. In addition, a detailed study of the structure of PrP 89-143 is presented. PrP 89-143 is a 54 residue fragment of the prion proteins which, upon mutation and aggregation, can induce prion diseases in transgenic mice. Whereas the structure of the wild-type PrP 89-143 is a generally unstructured mixture of α-helical and β-sheet conformers in the solid state, the aggregates formed from the PrP 89-143 mutants appear to be mostly β-sheet.

  8. Dynamic characteristics of resonant gyroscopes study based on the Mathieu equation approximate solution

    Institute of Scientific and Technical Information of China (English)

    Fan Shang-Chun; Li Yan; Guo Zhan-She; Li Jing; Zhuang Hai-Han

    2012-01-01

    Dynamic characteristics of the resonant gyroscope are studied based on the Mathieu equation approximate solution in this paper.The Mathieu equation is used to analyze the parametric resonant characteristics and the approximate output of the resonant gyroscope.The method of small parameter perturbation is used to analyze the approximate solution of the Mathieu equation.The theoretical analysis and the numerical simulations show that the approximate solution of the Mathieu equation is close to the dynamic output characteristics of the resonant gyroscope.The experimental analysis shows that the theoretical curve and the experimental data processing results coincide perfectly,which means that the approximate solution of the Mathieu equation can present the dynamic output characteristic of the resonant gyroscope.The theoretical approach and the experimental results of the Mathieu equation approximate solution are obtained,which provides a reference for the robust design of the resonant gyroscope.

  9. Study of node and mass sensitivity of resonant mode based cantilevers with concentrated mass loading

    Science.gov (United States)

    Zhang, Kewei; Chai, Yuesheng; Fu, Jiahui

    2015-12-01

    Resonant-mode based cantilevers are an important type of acoustic wave based mass-sensing devices. In this work, the governing vibration equation of a bi-layer resonant-mode based cantilever attached with concentrated mass is established by using a modal analysis method. The effects of resonance modes and mass loading conditions on nodes and mass sensitivity of the cantilever were theoretically studied. The results suggested that the node did not shift when concentrated mass was loaded on a specific position. Mass sensitivity of the cantilever was linearly proportional to the square of the point displacement at the mass loading position for all the resonance modes. For the first resonance mode, when mass loading position xc satisfied 0 xc xc ≤ l. Mass sensitivity did not change when concentrated mass was loaded at the rigid end. This work can provide scientific guidance to optimize the mass sensitivity of a resonant-mode based cantilever.

  10. A study of nasal cavity volume by magnetic resonance imaging

    Energy Technology Data Exchange (ETDEWEB)

    Tosa, Yasuyoshi (Showa Univ., Tokyo (Japan). School of Medicine)

    1992-04-01

    The nasal cavity volume in 69 healthy volunteers from 8 to 23 years old (17 males and 52 females) was studied using magnetic resonance imaging (MRI). Merits of MRI such as no radiation exposure, less artifact due to bone and air and measurement of intravascular blood flow; and demerits such as contraindication in users of heart pace-makers or magnetic clips, contraindication in people with claustrophobia and influence of environmental magnetic fields must be considered. A Magunetom M10 (Siemens), a superconduction device with 1.0 Tesla magnetic flux density was used. Enhanced patterns of T[sub 1], and pulse lines were photographed at 600 msec TR (repetition time) and 19 msec TE (echo time) using SE (spin echo) and short SE (spin echo), and 3 or 4 mm slices. Photographs were made of the piriform aperture, choana, superior-middle-inferior concha including the nasal meatus, the frontal sinus, maxillary sinus, cribriform plate, and upper surface of the palate. The line connecting the maximum depression point in the nasal root and the pontomedullary junction was selected by sagittal median section, because this corresponds well with the CM (canthomeatal) line which is useful in CT (computed tomography). The transverse section of the nasal cavity volume was traced by display console with an accessory MRI device and calculated by integration of the slice width. The increase of height and body weight neared a plateau at almost 16 years, whereas increase of nasal cavity volume continued until about 20 years. Pearson's coefficient of correlation and regression line were significant. There were no significant differences in these parameters between male and female groups. Comparatively strong correlation between nasal cavity volume, and age, height and body weight was statistically evident. (author).

  11. RESPECT: Neutron resonance spin-echo spectrometer for extreme studies

    Science.gov (United States)

    Georgii, R.; Kindervater, J.; Pfleiderer, C.; Böni, P.

    2016-11-01

    We propose the design of a REsonance SPin-echo spECtrometer for exTreme studies, RESPECT, that is ideally suited for the exploration of non-dispersive processes such as diffusion, crystallization, slow dynamics, tunneling processes, crystal electric field excitations, and spin fluctuations. It is a variant of the conventional neutron spin-echo technique (NSE) by (i) replacing the long precession coils by pairs of longitudinal neutron spin-echo coils combined with RF-spin flippers and (ii) by stabilizing the neutron polarization with small longitudinal guide fields that can in addition be used as field subtraction coils thus allowing to adjust the field integrals over a range of 8 orders of magnitude. Therefore, the dynamic range of RESPECT can in principle be varied over 8 orders of magnitude in time, if neutrons with the required energy are made available. Similarly as for existing NSE-spectrometers, spin echo times of up to approximately 1 μs can be reached if the divergence and the correction elements are properly adjusted. Thanks to the optional use of neutron guides and the fact that the currents for the correction coils are much smaller than in standard NSE, intensity gains of at least one order of magnitude are expected, making the concept of RESPECT also competitive for operation at medium flux neutron sources. RESPECT can also be operated in a MIEZE configuration allowing the investigation of relaxation processes in depolarizing environments as they occur when magnetic fields are applied at the sample position, i.e. for the investigation of the dynamics of flux lines in superconductors, magnetic fluctuations in ferromagnetic materials, and samples containing hydrogen.

  12. The GLP-1 Analogue Exenatide Improves Hepatic and Muscle Insulin Sensitivity in Diabetic Rats: Tracer Studies in the Basal State and during Hyperinsulinemic-Euglycemic Clamp

    Directory of Open Access Journals (Sweden)

    Hui Wu

    2014-01-01

    Full Text Available Objective. Glucagon-like peptide-1 (GLP-1 analogues (e.g., exenatide increase insulin secretion in diabetes but less is known about their effects on glucose production or insulin-stimulated glucose uptake in peripheral tissues. Methods. Four groups of Sprague-Dawley rats were studied: nondiabetic (control, C; nondiabetic + exenatide (C + E; diabetic (D; diabetic + exenatide (D + E with diabetes induced by streptozotocin and high fat diet. Infusion of 3-3H-glucose and U-13C-glycerol was used to measure basal rates of appearance (Ra of glucose and glycerol and gluconeogenesis from glycerol (GNG. During hyperinsulinemic-euglycemic clamp, glucose uptake into gastrocnemius muscles was measured with 2-deoxy-D-14C-glucose. Results. In the diabetic rats, exenatide reduced the basal Ra of glucose (P<0.01 and glycerol (P<0.01 and GNG (P<0.001. During the clamp, Ra of glucose was also reduced, whereas the rate of disappearance of glucose increased and there was increased glucose uptake into muscle (P<0.01 during the clamp. In the nondiabetic rats, exenatide had no effect. Conclusion. In addition to its known effects on insulin secretion, administration of the GLP-1 analogue, exenatide, is associated with increased inhibition of gluconeogenesis and improved glucose uptake into muscle in diabetic rats, implying improved hepatic and peripheral insulin sensitivity.

  13. Study and application of the resonant secular dynamics beyond Neptune

    CERN Document Server

    Saillenfest, Melaine; Tommei, Giacomo; Valsecchi, Giovanni B

    2016-01-01

    We use a secular representation to describe the long-term dynamics of transneptunian objects in mean-motion resonance with Neptune. The model applied is thoroughly described in Saillenfest et al. (2016). The parameter space is systematically explored, showing that the secular trajectories depend little on the resonance order. High-amplitude oscillations of the perihelion distance are reported and localised in the space of the orbital parameters. In particular, we show that a large perihelion distance is not a sufficient criterion to declare that an object is detached from the planets. Such a mechanism, though, is found unable to explain the orbits of Sedna or 2012VP113, which are insufficiently inclined (considering their high perihelion distance) to be possibly driven by such a resonant dynamics. The secular representation highlights the existence of a high-perihelion accumulation zone due to resonances of type 1:k with Neptune. That region is found to be located roughly at semi-major axes in [100;300] AU, p...

  14. Study of the geometrical resonances of superconducting tunnel junctions

    DEFF Research Database (Denmark)

    Sørensen, O. Hoffmann; Finnegan, T.F.; Pedersen, Niels Falsig

    1973-01-01

    The resonant cavity structure of superconducting Sn-Sn-oxide-Sn tunnel junctions has been investigated via photon-assisted quasiparticle tunneling. We find that the temperature-dependent losses at 35 GHz are determined by the surface resistance of the Sn films for reduced temperatures between 0...

  15. Nuclear Quadrupole Resonance Studies of Charge Distributions in Molecular Solids.

    Science.gov (United States)

    Greenbaum, Steven Garry

    A detailed description of an NMR-NQR double resonance spectrometer designed and constructed in this laboratory is given, including some instruction on its use. ('14)N NQR data obtained by pulse methods for six classes of nitrogen-containing compounds are presented and analyzed in the framework of the Townes and Dailey theory. A study of the anti-cancer drugs cyclophosphamide, isophosphamide and triphosphamide suggests the existence of a correlation between the substance's chemotherapeutic efficacy and the (pi) - (sigma)(,NP) charge density at the trigonal nitrogen. Satisfactory correlations of the NQR spectra of 22 monosubstituted anilines with both the Hammett (sigma) parameters and the in vitro biological activities of the corresponding sulfanilamides have been found, indicating that the nitrogen lone-pair orbital is more sensitive than the nitrogen-carbon sigma orbital is to substituent effects. NQR spectra of several N-acetyl amino acids and related compounds are reported. The inductive effect of the chloroacetyl group on the nitrogen is discussed. A positive correlation between the (pi) - (sigma)(,NC) electron density at the nitrogen and the Taft inductive parameter (sigma)* is observed, suggesting that the nitrogen (pi) -charge density in the N-acetyl amino acids does not vary appreciably. Both ('14)N and ('35)Cl NQR data have been obtained for a series of compounds containing nitrogen directly bonded to chlorine. The existence of a linear correlation between the ('14)N and ('35)Cl quadrupole coupling constants is interpreted in terms of a simple model dealing with charge excesses and deficiencies at the respective nuclei. A study of two complexes of 4-aminopyridine (4AP) addresses the loss of pyridine nitrogen lone-pair charge upon formation of the strong and asymmetric N-H-N bond characteristic of these complexes. Evidence of hydrogen bonding interactions involving the amino nitrogens is found to be in agreement with a published neutron diffraction study

  16. Magnetic Resonance Spectroscopic Imaging (MRSI Study of Breast Cancer

    Directory of Open Access Journals (Sweden)

    K. B. Ashok

    2011-05-01

    Full Text Available Background: Breast cancer is the fifth most common cause of cancer death worldwide and most serious form of neoplastic diseases in both developed and developing countries. Mammography and ultrasound are the most often used screening methods in breast cancer. Magnetic Resonance Imaging (MRI uses the protons in water and fat to create the image of breast cancer. But recent studies says neoplastic breast lesions contains elevated choline concentration (tCho and altered mean apparent diffusion coefficient (ADC which can be used as good biomarkers to evaluate the cancer stages even follow up the Neoadjuvent Chemotherapy (NACT.Aim & Objectives:1. To evaluate the relation of age, tCho concentration and mean ADC with breast cancer.2. To estimate the correlation between the factors.3. To calculate the main difference between breast cancer patient before and after menopause.Methods/Study Design: This was a cross sectional, observational study done on 14 randomly selected diagnosed stage I breast cancer patients newly registered in surgery department of All India Institute of Medical Sciences, New Delhi, India during 3 months study period. Intentionally 7 of them were selected to be postmenopausal and rest 7 premenopausal. Patients with claustrophobia, serious illness, pacemaker or associated diseases were excluded. Volunteers were selected by lottery method after confirmation of absence of the exclusion criteria in them. All the breast MRS images were taken only after signing the consent form of being a volunteer for the study with breast coil. All the spectroscopic images were analyzed with computer technologies and SPPS software with the help of non-parametric statistical tests.Results/Findings: Mean age of patients were 44.85±6.97 where in premenopausal and postmenopausal women it was 40.14±4.59 and 49.57±5.26 respectively. tCho concentration was high in postmenopausal women (4.85±2.64 mmol/kg vs 3.72±1.64 where unlike to them premenopausal women

  17. ACTINOMYCIN D ANALOGUES

    DEFF Research Database (Denmark)

    1997-01-01

    The present invention relates to new compounds being structurally and functionally similar to Actinomycin D and to combinatorial libraries of such compounds. The Actinomycin D analogues according to the present invention comprise two linear or cyclic peptide moieties constituted by $g...

  18. Study of $^{13}$Be through isobaric analog resonances in the Maya active target

    CERN Multimedia

    Riisager, K; Orr, N A; Jonson, B N G; Raabe, R; Fynbo, H O U; Nilsson, T

    We propose to perform an experiment with a $^{12}$Be beam and the Maya active target. We intend to study the ground state of $^{13}$Be through the population of its isobaric analog resonance in $^{13}$B. The resonance will be identified detecting its proton- and neutron-decay channels.

  19. Magnetic resonance spectroscopy may hold promise in studying metabolites, tissues

    Energy Technology Data Exchange (ETDEWEB)

    1989-02-24

    Almost 15 years ago, in a basement at Chicago's University of Illinois Medical Center, Michael Barany, MD, PhD, measured phosphorus metabolites in an intact frog muscle using magnetic resonance spectroscopy (MRS). Prior to that, chemists used spectroscopy solely to analyze the contents of test tubes. Only a British group preceded Barany in proving that it would work in tissue as well. Today, he does spectroscopy clinically, one day a week, at the Greenberg Radiology Institute in Highland Park, IL, north of Chicago. Barany says that he can distinguish malignant from benign tumors in the living brain. The tool he uses is a standard magnetic resonance imaging (MRI) machine. While MRI capabilities have forged ahead, human MRS has been awaiting improvements in magnet and computer technology. Barany is one of a number of researchers who, since the early 1980s, have been developing MRS technology and techniques so that it can be done in the human body.

  20. Experimental and Theoretical Studies of Pressure Broadened Alkali-Metal Atom Resonance Lines

    Science.gov (United States)

    Shindo, F.; Zhu, C.; Kirby, K.; Babb, J. F.

    2006-01-01

    We are carrying out a joint theoretical and experimental research program to study the broadening of alkali atom resonance lines due to collisions with helium and molecular hydrogen for applications to spectroscopic studies of brown dwarfs and extrasolar giant planets.

  1. Monochromatic excimer light versus combination of topical steroid with vitamin D3 analogue in the treatment of nonsegmental vitiligo: a randomized blinded comparative study.

    Science.gov (United States)

    Abdel Latif, Azmy Ahmed; Ibrahim, Shady Mahmoud Attia

    2015-01-01

    Vitiligo is a difficult disease to treat, socially stigmatizing its patients. Monochromatic excimer light (MEL) was developed for use in dermatology and adapted for the treatment of vitiligo. Comparing the efficacy of MEL versus topical combination therapy of vitamin D3 analogue and steroid in the treatment of nonsegmental vitiligo. Forty-four patients with localized and stable nonsegmental vitiligo participated in the present study. In each patient, two lesions were selected and divided randomly into two groups, group A was treated with daily topical combination of calcipotriol and betamethasone and group B was treated with biweekly sessions of MEL for 3 months. Efficacy based on repigmentation percentages were blindly evaluated by two independent physicians and patient's satisfaction. There was significant improvement in both treatment modalities at the end of the study, but without significant differences in both groups. There was a significant difference between both groups regarding the onset of repigmentation (p-value vitiligo.

  2. Assessment of pruritus intensity: prospective study on validity and reliability of the visual analogue scale, numerical rating scale and verbal rating scale in 471 patients with chronic pruritus.

    Science.gov (United States)

    Phan, Ngoc Quan; Blome, Christine; Fritz, Fleur; Gerss, Joachim; Reich, Adam; Ebata, Toshiya; Augustin, Matthias; Szepietowski, Jacek C; Ständer, Sonja

    2012-09-01

    The most commonly used tool for self-report of pruritus intensity is the visual analogue scale (VAS). Similar tools are the numerical rating scale (NRS) and verbal rating scale (VRS). In the present study, initiated by the International Forum for the Study of Itch assessing reliability of these tools, 471 randomly selected patients with chronic itch (200 males, 271 females, mean age 58.44 years) recorded their pruritus intensity on VAS (100-mm line), NRS (0-10) and VRS (four-point) scales. Re-test reliability was analysed in a subgroup of 250 patients after one hour. Statistical analysis showed a high reliability and concurrent validity (r>0.8; pscales showed a high correlation. In conclusion, high reliability and concurrent validity was found for VAS, NRS and VRS. On re-test, higher correlation and less missing values were observed. A training session before starting a clinical trial is recommended.

  3. Accurate Characterization of the Peptide Linkage in the Gas Phase: a Joint Quantum-Chemical and Rotational Spectroscopy Study of the Glycine Dipeptide Analogue

    Science.gov (United States)

    Puzzarini, Cristina; Biczysko, Malgorzata; Barone, Vincenzo; Largo, Laura; Peña, Isabel; Cabezas, Carlos; Alonso, José L.

    2014-06-01

    Accurate structures of aminoacids in the gas phase have been obtained by joint microwave and quantum-chemical investigations. However, the structure and conformational behavior of α-aminoacids once incorporated into peptide chains are completely different and have not yet been characterized with the same accuracy. To fill this gap, we present here an accurate characterization of the simplest dipeptide analogue (N-acetylglycinamide) involving peptidic bonds. State-of-the-art quantum-chemical computations are complemented by a comprehensive study of the rotational spectrum using a combination of Fourier transform microwave spectroscopy with laser ablation. The coexistence of the C_7 and C_5 conformers has been proved and energetically as well as spectroscopically characterized. This joint theoretical-experimental investigation demonstrated the feasibility of obtaining accurate structures for flexible small biomolecules, thus paving the route to the elucidation of the inherent behavior of peptides.

  4. Numerical study of heterogeneous mean temperature and shock wave in a resonator

    Energy Technology Data Exchange (ETDEWEB)

    Yano, Takeru [Department of Mechanical Engineering, Osaka University, Suita 565-0871 (Japan)

    2015-10-28

    When a frequency of gas oscillation in an acoustic resonator is sufficiently close to one of resonant frequencies of the resonator, the amplitude of gas oscillation becomes large and hence the nonlinear effect manifests itself. Then, if the dissipation effects due to viscosity and thermal conductivity of the gas are sufficiently small, the gas oscillation may evolve into the acoustic shock wave, in the so-called consonant resonators. At the shock front, the kinetic energy of gas oscillation is converted into heat by the dissipation process inside the shock layer, and therefore the temperature of the gas in the resonator rises. Since the acoustic shock wave travels in the resonator repeatedly over and over again, the temperature rise becomes noticeable in due course of time even if the shock wave is weak. We numerically study the gas oscillation with shock wave in a resonator of square cross section by solving the initial and boundary value problem of the system of three-dimensional Navier-Stokes equations with a finite difference method. In this case, the heat conduction across the boundary layer on the wall of resonator causes a spatially heterogeneous distribution of mean (time-averaged) gas temperature.

  5. Gastric inhibitory polypeptide analogues

    DEFF Research Database (Denmark)

    Holst, Jens Juul

    2002-01-01

    of GIP and GLP-1 receptors, the incretin effect is essential for normal glucose tolerance. In patients with type 2 diabetes mellitus it turns out that the incretin effect is severely impaired or abolished. The explanation seems to be that both the secretion of GLP-1 and the effect of GIP are impaired...... (whereas both the secretion of GIP and the effect of GLP-1 are near normal). The impaired GLP-1 secretion is probably a consequence of diabetic metabolic disturbances. The known genetic variations in the GIP receptor sequence are not associated with type 2 diabetes mellitus, but a defective insulinotropic...... and its analogues are attractive as therapeutic agents for type 2 diabetes mellitus, analogues of GIP are unlikely to be effective. On the other hand, GIP seems to play an important role in lipid metabolism, promoting the disposal of ingested lipids, and mice with a targeted deletion of the GIP receptor...

  6. Formation of metal nanoparticles in silicon nanopores: Plasmon resonance studies

    Science.gov (United States)

    Polisski, S.; Goller, B.; Heck, S. C.; Maier, S. A.; Fujii, M.; Kovalev, D.

    2011-01-01

    We present a method for the formation of noble metal nanoparticle ensembles in nanostructured silicon. The key idea is based on the unique property of the large reduction potential of extended internal hydrogen-terminated porous silicon surfaces. The process of metal nanoparticle formation in porous silicon was experimentally traced using their optical plasmon resonance response. We also demonstrate that bimetallic compounds can be formed in porous silicon and that their composition can be controlled using this technique. Experimental results were found to contradict partially with considerations based on Mie theory.

  7. Role of magnetic resonance perfusion studies in moyamoya disease

    Directory of Open Access Journals (Sweden)

    Khanna Paritosh

    2004-04-01

    Full Text Available Moyamoya disease, Japanese for ′puff of smoke′, is a rare disease that presents most commonly with recurrent TIAs (transient ischemic attacks / stroke in childhood. Ischemic symptoms in patients with moyamoya disease are usually due to hemodynamically-mediated perfusion failure. Identification of abnormal tissue perfusion is an important aspect of the evaluation of these patients. We present the radiological features including the Magnetic Resonance (MR Perfusion findings illustrating the hemodynamic changes of cerebral ischemia in a case of moyamoya disease.

  8. Molecular Dynamics Study on the Resonance Properties of a Nano Resonator Based on a Graphene Sheet with Two Types of Vacancy Defects

    Directory of Open Access Journals (Sweden)

    Wenchao Tian

    2017-01-01

    Full Text Available Due to the excellent electronic, optical, thermal, chemical, and mechanical properties of graphene, it has been applied in microdevices and nanodevices. However, there are some structural defects in graphene limiting its application in micro electromechanical systems (MEMS. These structural defects are inevitable during processing, and it is difficult to assess their effect on the micro/nano devices. Therefore, this communication used molecular dynamics to study the resonance properties of a nanoelectromechanical systems (NMES resonator based on a graphene sheet with a single vacancy defect and edge defects. This communication focuses on three factors: vacancy types, external force, and temperature. The resonance frequencies of both types of graphene increased with external stress loading, and the resonance frequency of the graphene showed a clear step-shaped variation. Nonlinear deformation of the sheet occurred between resonant processes. When the external force was less than 15.91 nN, the resonance frequencies of the two types of graphene showed a consistent trend. The maximum frequency was up to 132.90 GHz. When the external force was less than 90 nN, the resonance frequencies of graphene with edge defects were greater and changed more rapidly. Temperature did not have a huge influence on the resonance frequencies of either type of graphene structure. The resonance frequencies of graphene with two different vacancy defects showed a consistent trend.

  9. Quantum analogue computing.

    Science.gov (United States)

    Kendon, Vivien M; Nemoto, Kae; Munro, William J

    2010-08-13

    We briefly review what a quantum computer is, what it promises to do for us and why it is so hard to build one. Among the first applications anticipated to bear fruit is the quantum simulation of quantum systems. While most quantum computation is an extension of classical digital computation, quantum simulation differs fundamentally in how the data are encoded in the quantum computer. To perform a quantum simulation, the Hilbert space of the system to be simulated is mapped directly onto the Hilbert space of the (logical) qubits in the quantum computer. This type of direct correspondence is how data are encoded in a classical analogue computer. There is no binary encoding, and increasing precision becomes exponentially costly: an extra bit of precision doubles the size of the computer. This has important consequences for both the precision and error-correction requirements of quantum simulation, and significant open questions remain about its practicality. It also means that the quantum version of analogue computers, continuous-variable quantum computers, becomes an equally efficient architecture for quantum simulation. Lessons from past use of classical analogue computers can help us to build better quantum simulators in future.

  10. An exploratory study on the peroxyl-radical-scavenging activity of 2,6-dimethyl-5-hepten-2-ol and its heterocyclic analogues

    Science.gov (United States)

    Stobiecka, Agnieszka; Sikora, Magdalena; Bonikowski, Radosław; Kula, Józef

    2016-03-01

    The structural properties and radical scavenging activity of 2,6-dimethyl-5-hepten-2-ol (1) and its new heterocyclic analogues, i.e. 2-methyl-4-(5-methylfuran-2-yl)-butan-2-ol (2) and 2-methyl-4-(5-methylthiophen-2-yl)-butan-2-ol (3) and have been studied by using the experimental and theoretical methods for the first time. Activity of title compounds against the peroxyl radical was determined by using standard fluorimetric test, i.e. the Oxygen Radical Absorbance Capacity assay (ORACFL). Furthermore, the electron-donating ability of odorants has been evaluated by using colorimetric ABTS assay. According to the experimental results obtained from the ORACFL test 2,6-dimethyl-5-hepten-2-ol was characterized by the highest activity in comparison with the novel counterparts. Nevertheless, all investigated compounds exhibited pronounced anti-peroxyl radical activity comparable to that exerted by the one of the most prominent antioxidant among the monoterpene alcohols, i.e. by linalool. On the other hand, the title compounds exerted relatively low capacity to quench the radical cation of ABTS. Theoretical calculations based on the Density Functional Theory (DFT) method with the hybrid functional B3LYP were carried out in order to investigate selected structural and electronic properties including the geometrical parameters as well as the energy of frontier molecular orbitals of parent molecules and the resulting radicals. Furthermore, the possible mechanism of peroxyl-radical-scavenging has been determined by using the thermodynamic descriptors such as the bond dissociation enthalpies (BDEs) and ionization potentials (IPs). These theoretical data pointed out the relevance of HAT mechanism in the peroxyl-radical-scavenging exhibited by 2,6-dimethyl-5-hepten-2-ol and its new heterocyclic analogues in polar and non-polar medium.

  11. Experimental studies on perturbed acoustic resonant spectroscopy by a small rock sample in a cylindrical cavity

    Institute of Scientific and Technical Information of China (English)

    CHEN Dehua; WANG Xiuming; CONG Jiansheng; XU Delong; SONG Yanjie; MA Shuilong

    2006-01-01

    A measurement system for acoustic resonant spectroscopy (ARS) is established,and the effects of resonant cavity geometry,inner perturbation samples and environmental temperature on the ARS are investigated.The ARSs of the small samples with various sizes and acoustic properties are measured.The results show that at the normal pressure,the resonant frequency decreases gradually with the increase of liquid temperature in the cylindrical cavity,while the resonant amplitude increases.At certain pressure and temperature,both the resonant frequency and the amplitude decrease greatly when there exist air bubbles inside the cavity fluid.The ARS is apparently affected by the sample porosity and the sample location in the resonant cavity.At the middle of the cavity,the resonant frequencies reach their maximum values for all of the measurement samples.The resonant frequencies of the porous rock samples are smaller than those of the compacted samples if other acoustic parameters are the same.As the sample is moved from the top to the middle of the cavity along its axis,the resonant amplitude increases gradually for the compacted rocks while decreases for the unconsolidated rocks.Furthermore,the resonant amplitude increases firstly and then decreases if the porosity of the rock sample is relatively small.In addition,through the comparisons between the experimental and theoretical results,it is found that the effects of the acoustic parameters and sizes of the samples and the size of the cylindrical cavity on the laboratory results agree well with the theoretical ones qualitatively.These results may provide basic reference for the experiment study of rock acoustic properties in a low frequency using ARS.

  12. Investigations of neutron-rich nuclei at the dripline through their analogue states : The cases of $^{10}$Li - $^{10}$Be (T=2) and $^{17}$C - $^{17}$N (T=5/2)

    CERN Multimedia

    2002-01-01

    We propose to study the elastic resonance scattering reactions $^{9}$Li+p and $^{16}$C+p to investigate the energies, spins and parities of the lowest T=2 states in $^{10}$Be and the T=5/2 states in $^{17}$N. These are analogue states of the ground states and first excited states in $^{10}$Li and $^{17}$C.

  13. High Resolution Magic Angle Spinning Nuclear Magnetic Resonance (HRMAS NMR) for Studies of Reactive Fabrics

    Science.gov (United States)

    2015-11-01

    Magnetic Resonance (HRMAS NMR) for Studies of Reactive Fabrics 5a. CONTRACT NUMBER W911SR-11-C-0047 5b. GRANT NUMBER 5c. PROGRAM ELEMENT NUMBER...ECBC-TR-1326 HIGH RESOLUTION MAGIC ANGLE SPINNING NUCLEAR MAGNETIC RESONANCE (HRMAS NMR) FOR STUDIES OF REACTIVE FABRICS David J. McGarvey...unlimited. 13. SUPPLEMENTARY NOTES 14. ABSTRACT An analytical chemistry method is described for measuring the reactivity and permeation of

  14. Study of resonance production as a probe of heavy-ion collisions with the ALICE detector

    CERN Document Server

    CERN. Geneva

    2017-01-01

    Hadronic resonances provide a rich set of measurements that can be used to study the properties of ultra-relativistic heavy-ion collisions. Measurements of resonances and long-lived particles provide information about the properties of the late hadronic phase due to the presence of scattering effects that can modify resonance yields. Resonances can also be used along with long-lived hadrons to study the various mechanisms that shape particle pT spectra, including in-medium energy loss, radial flow, and recombination. Measurements of resonances in pp and p-Pb collisions serve as baselines for measurements in heavy-ion collisions, provide input for tuning QCD-inspired event generators, and aid searches for collective behavior in small systems. I will present measurements of a wide variety of hadronic resonances, including some of the most recent results presented at the Quark Matter conference. By comparing measurements of resonances with different masses, lifetimes, and quark contents in pp, p-Pb, and Pb-Pb co...

  15. Synthesis of novel tricyclic oxazolidinones by a tandem SN2 and SNAr reaction: SAR studies on conformationally constrained analogues of Linezolid.

    Science.gov (United States)

    Selvakumar, N; Yadi Reddy, B; Sunil Kumar, G; Khera, Manoj Kumar; Srinivas, D; Sitaram Kumar, M; Das, Jagattaran; Iqbal, Javed; Trehan, Sanjay

    2006-08-15

    A series of conformationally constrained analogues of Linezolid were synthesised by employing a tandem SN(2) and SNAr reaction as the key step and tested for antibacterial activity. While the hexahydroazolo-quinoxaline compounds were inactive, the tetrahydroazolo-benzothiazine compounds exhibited interesting antibacterial activity. The introduction of fluorine in the aromatic ring further made the compounds more potent in acetamide compounds resulting in an interesting analogue 32. However, the introduction of fluorine (analogue 34) on the already potent non-fluorine thiocarbamate 21 did not have any influence on the activity.

  16. Nuclear magnetic and quadrupole resonance studies of the stripes materials

    Energy Technology Data Exchange (ETDEWEB)

    Grafe, H.-J., E-mail: h.grafe@ifw-dresden.de [IFW Dresden, Institute for Solid State Research, P.O. Box 270116, D-01171 Dresden (Germany)

    2012-11-01

    Nuclear Magnetic and Quadrupole Resonance (NMR/NQR) is a powerful tool to probe electronic inhomogeneities in correlated electron systems. Its local character allows for probing different environments due to spin density modulations or inhomogeneous doping distributions emerging from the correlations in these systems. In fact, NMR/NQR is not only sensitive to magnetic properties through interaction of the nuclear spin, but also allows to probe the symmetry of the charge distribution and its homogeneity, as well as structural modulations, through sensitivity to the electric field gradient (EFG). We review the results of NMR and NQR in the cuprates from intrinsic spatial variations of the hole concentration in the normal state to stripe order at low temperatures, thereby keeping in mind the influence of doping induced disorder and inhomogeneities. Finally, we briefly discuss NQR evidence for local electronic inhomogeneities in the recently discovered iron pnictides, suggesting that electronic inhomogeneities are a common feature of correlated electron systems.

  17. Resonantly Enhanced Multiphoton Ionization under XUV FEL radiation: A case study of the role of harmonics

    CERN Document Server

    Nikolopoulos, Georgios M

    2016-01-01

    We provide a detailed quantitative study of the possible role of a small admixture of harmonics on resonant two-photon ionization. The motivation comes from the occasional presence of 2nd and 3rd harmonics in FEL radiation. We obtain the dependence of ionic yields on the intensity of the fundamental, the percentage of 2nd harmonic and the detuning of the fundamental from resonance. Having examined the cases of one and two intermediate resonances, we arrive at results of general validity and global behavior, showing that even a small amount of harmonic may seem deceptively innocuous.

  18. Numerical Simulation Study of the Montague Resonance at the CERN Proton Synchrotron

    CERN Document Server

    Qiang, J; Franchetti, G; Hofmann, I; Metral, E

    2012-01-01

    The Montague resonance provides a coupling between the vertical and the horizontal dynamics of beam and can cause particle losses due to unequal aperture sizes of the accelerator. In this paper, we present a new numerical simulation study of a previous Montague resonance crossing experiment at the CERN PS including detailed three-dimensional space-charge effects and machine nonlinearity. The simulation reproduces the experimental data well and suggests that the longitudinal synchrotron motion played an important role in enhancing transverse resonance coupling.

  19. Study of 234U(n,f) Resonances Measured at the CERN n_TOF Facility

    CERN Document Server

    Leal-Cidoncha, E; Paradela, C; Tarrío, D; Leong, L S; Audouin, L; Tassan-Got, L; Praena, J; Berthier, B; Ferrant, L; Isaev, S; Le Naour, C; Stephan, C; Trubert, D; Abbondanno, U; Aerts, G; Álvarez, H; Álvarez-Velarde, F; Andriamonje, S; Andrzejewski, J; Badurek, G; Baumann, P; Bečvář, F; Berthoumieux, E; Calviño, F; Calviani, M; Cano-Ott, D; Capote, R; Carrapiço, C; Cennini, P.; Chepel, V; Chiaveri, E.; Colonna, N; Cortes, G; Couture, A; Cox, J; Dahlfors, M; David, S.; Dillmann, I; Domingo-Pardo, C; Dridi, W; Eleftheriadis, C; Embid-Segura, M; Ferrari, A.; Ferreira-Marques, R; Fujii, K; Furman, W; Gonçalves, I; González-Romero, E; Gramegna, F; Guerrero, C; Gunsing, F; Haas, B; Haight, R; Heil, M; Herrera-Martinez, A.; Igashira, M; Jericha, E; Kadi, Y.; Käppeler, F; Karadimos, D; Kerveno, M; Koehler, P; Kossionides, E; Krtička, M; Lampoudis, C; Leeb, H; Lindote, A; Lopes, I; Lozano, M; Lukic, S; Marganiec, J; Marrone, S; Martínez, T; Massimi, C; Mastinu, P; Mengoni, A; Milazzo, P M; Moreau, C; Mosconi, M; Neves, F; Oberhummer, H; O'Brien, S; Oshima, M; Pancin, J; Papadopoulos, C; Pavlik, A; Pavlopoulos, P.; Perrot, L; Pigni, M T; Plag, R; Plompen, A; Plukis, A; Poch, A; Pretel, C; Quesada, J; Rauscher, T.; Reifarth, R; Rubbia, C.; Rudolf, G; Rullhusen, P; Salgado, J; Santos, C; Sarchiapone, L.; Savvidis, I; Tagliente, G; Tain, J L; Tavora, L; Terlizzi, R; Vannini, G; Vaz, P; Ventura, A.; Villamarin, D; Vincente, M C; Vlachoudis, V.; Vlastou, R; Voss, F; Walter, S; Wiescher, M; Wisshak, K

    2014-01-01

    We present the analysis of the resolved resonance region for the U-234(n,f) cross section data measured at the CERN n\\_TOF facility. The resonance parameters in the energy range from 1 eV to 1500 eV have been obtained with the SAMMY code by using as initial parameters for the fit the resonance parameters of the JENDL-3.3 evaluation. In addition, the statistical analysis has been accomplished, partly with the SAMDIST code, in order to study the level spacing and the Mehta-Dyson correlation.

  20. Surface plasmon enhanced interfacial electron transfer and resonance Raman, surface-enhanced resonance Raman studies of cytochrome C mutants

    Energy Technology Data Exchange (ETDEWEB)

    Zheng, Junwei [Iowa State Univ., Ames, IA (United States)

    1999-11-08

    Surface plasmon resonance was utilized to enhance the electron transfer at silver/solution interfaces. Photoelectrochemical reductions of nitrite, nitrate, and CO2 were studied on electrochemically roughened silver electrode surfaces. The dependence of the photocurrent on photon energy, applied potential and concentration of nitrite demonstrates that the photoelectrochemical reduction proceeds via photoemission process followed by the capture of hydrated electrons. The excitation of plasmon resonances in nanosized metal structures resulted in the enhancement of the photoemission process. In the case of photoelectrocatalytic reduction of CO2, large photoelectrocatalytic effect for the reduction of CO2 was observed in the presence of surface adsorbed methylviologen, which functions as a mediator for the photoexcited electron transfer from silver metal to CO2 in solution. Photoinduced reduction of microperoxidase-11 adsorbed on roughened silver electrode was also observed and attributed to the direct photoejection of free electrons of silver metal. Surface plasmon assisted electron transfer at nanostructured silver particle surfaces was further determined by EPR method.

  1. Surface plasmon enhanced interfacial electron transfer and resonance Raman, surface-enhanced resonance Raman studies of cytochrome C mutants

    Energy Technology Data Exchange (ETDEWEB)

    Zheng, Junwei

    1999-11-08

    Surface plasmon resonance was utilized to enhance the electron transfer at silver/solution interfaces. Photoelectrochemical reductions of nitrite, nitrate, and CO{sub 2} were studied on electrochemically roughened silver electrode surfaces. The dependence of the photocurrent on photon energy, applied potential and concentration of nitrite demonstrates that the photoelectrochemical reduction proceeds via photoemission process followed by the capture of hydrated electrons. The excitation of plasmon resonances in nanosized metal structures resulted in the enhancement of the photoemission process. In the case of photoelectrocatalytic reduction of CO{sub 2}, large photoelectrocatalytic effect for the reduction of CO{sub 2} was observed in the presence of surface adsorbed methylviologen, which functions as a mediator for the photoexcited electron transfer from silver metal to CO{sub 2} in solution. Photoinduced reduction of microperoxidase-11 adsorbed on roughened silver electrode was also observed and attributed to the direct photoejection of free electrons of silver metal. Surface plasmon assisted electron transfer at nanostructured silver particle surfaces was further determined by EPR method.

  2. Analogue Methods in Palaeoecology: Using the analogue Package

    OpenAIRE

    Simpson, Gavin L.

    2007-01-01

    Palaeoecology is an important branch of ecology that uses the subfossil remains of organisms preserved in lake, ocean and bog sediments to inform on changes in ecosystems and the environment through time. The analogue package contains functions to perform modern analogue technique (MAT) transfer functions, which can be used to predict past changes in the environment, such as climate or lake-water pH from species data. A related technique is that of analogue matching, which is concerned with i...

  3. Quality of life in patients with short bowel syndrome treated with the new glucagon-like peptide-2 analogue teduglutide--analyses from a randomised, placebo-controlled study

    DEFF Research Database (Denmark)

    Jeppesen, P B; Pertkiewicz, M; Forbes, A;

    2013-01-01

    Short bowel syndrome (SBS)-intestinal failure (IF) patients have impaired quality of life (QoL) and suffer from the burden of malabsorption and parenteral support (PS). A phase III study demonstrated that treatment with teduglutide, a glucagon-like peptide 2 analogue, reduces PS volumes by 32% wh...

  4. Geomagnetic properties of Proxima Centauri b analogues

    CERN Document Server

    Zuluaga, Jorge I

    2016-01-01

    The recent discovery of a planet around the closest star, Proxima Centauri, could represent a quantum leap on the testability of models in exoplanet sciences. Unlike any other discovered exoplanet, models of planetary processes in Proxima b could be contrasted against near future telescopic observations and far future in-situ measurements. In this paper we study the geomagnetic properties of Proxima b analogues, namely, solid planets with masses close but larger than Earth's mass, periods of rotation of several days and habitable surface conditions. Assuming different planetary masses, bulk compositions and periods of rotations, we calculate for each planetary analogue its radius, heat flux, time of inner core formation, dynamo lifetime and minimum dipole magnetic moment. We find that most ($\\gtrsim$70\\%) Proxima b analogues develop intrinsic dynamos that last at least 3 Gyr, although only half of them are older than the present age of the host star ($4-6$ Gyr). Relying in our planetary evolution models, we p...

  5. Resonant absorption induced fast melting studied with mid-IR QCLs

    Science.gov (United States)

    Lu, Jie; Lv, Yankun; Ji, Youxin; Tang, Xiaoliang; Qi, Zeming; Li, Liangbin

    2017-02-01

    We demonstrate the use of a pump-probe setup based on two mid-infrared quantum cascade lasers (QCLs) to investigate the melting and crystallization of materials through resonant absorption. A combination of pump and probe beams fulfills the two-color synchronous detection. Furthermore, narrow linewidth advances the accuracy of measurements and the character of broad tuning range of QCLs enables wide applications in various sample and multiple structures. 1-Eicosene was selected as a simple model system to verify the feasibility of this method. A pulsed QCL was tuned to the absorption peak of CH2 bending vibration at 1467 cm-1 to resonantly heat the sample. The other QCL in continuous mode was tuned to 1643 cm-1 corresponding the C=C stretching vibration to follow the fast melting dynamics. By monitoring the transmission intensity variation of pump and probe beams during pump-probe experiments, the resonant absorption induced fast melting and re-crystallization of 1-Eicosene can be studied. Results show that the thermal effect and melting behaviors strongly depend on the pump wavelength (resonant or non-resonant) and energy, as well as the pump time. The realization and detection of melting and recrystallization can be performed in tens of milliseconds, which improves the time resolution of melting process study based on general mid-infrared spectrum by orders of magnitude. The availability of resonant heating and detections based on mid-infrared QCLs is expected to enable new applications in melting study.

  6. Radiation-induced optic neuropathy: A magnetic resonance imaging study

    Energy Technology Data Exchange (ETDEWEB)

    Guy, J.; Mancuso, A.; Beck, R.; Moster, M.L.; Sedwick, L.A.; Quisling, R.G.; Rhoton, A.L. Jr.; Protzko, E.E.; Schiffman, J. (Univ. of Florida, Gainesville (USA))

    1991-03-01

    Optic neuropathy induced by radiation is an infrequent cause of delayed visual loss that may at times be difficult to differentiate from compression of the visual pathways by recurrent neoplasm. The authors describe six patients with this disorder who experienced loss of vision 6 to 36 months after neurological surgery and radiation therapy. Of the six patients in the series, two had a pituitary adenoma and one each had a metastatic melanoma, multiple myeloma, craniopharyngioma, and lymphoepithelioma. Visual acuity in the affected eyes ranged from 20/25 to no light perception. Magnetic resonance (MR) imaging showed sellar and parasellar recurrence of both pituitary adenomas, but the intrinsic lesions of the optic nerves and optic chiasm induced by radiation were enhanced after gadolinium-diethylenetriaminepenta-acetic acid (DTPA) administration and were clearly distinguishable from the suprasellar compression of tumor. Repeated MR imaging showed spontaneous resolution of gadolinium-DTPA enhancement of the optic nerve in a patient who was initially suspected of harboring recurrence of a metastatic malignant melanoma as the cause of visual loss. The authors found the presumptive diagnosis of radiation-induced optic neuropathy facilitated by MR imaging with gadolinium-DTPA. This neuro-imaging procedure may help avert exploratory surgery in some patients with recurrent neoplasm in whom the etiology of visual loss is uncertain.

  7. Insulin analogues and severe hypoglycaemia in type 1 diabetes

    DEFF Research Database (Denmark)

    Kristensen, P L; Hansen, L S; Jespersen, M J

    2012-01-01

    The effect of insulin analogues on glycaemic control is well-documented, whereas the effect on avoidance of severe hypoglycaemia remains tentative. We studied the frequency of severe hypoglycaemia in unselected patients with type 1 diabetes treated with insulin analogues, human insulin, or mixed...

  8. Structure-activity study of thiazides by magnetic resonance methods (NQR, NMR, EPR) and DFT calculations.

    Science.gov (United States)

    Latosińska, J N

    2005-01-01

    The paper presents a comprehensive analysis of the relationship between the electronic structure of thiazides and their biological activity. The compounds of interest were studied in solid state by the resonance methods nuclear quadrupole resonance (NQR), nuclear magnetic resonance (NMR) and electron paramagnetic resonance (EPR) and quantum chemistry (ab inito and DFT) methods. Detailed parallel analysis of the spectroscopic parameters such as quadrupole coupling constant (QCC) NQR chemical shift (delta), chemical shift anisotropy (CSA), asymmetry parameter (eta), NMR and hyperfine coupling constant (A), EPR was performed and the electronic effects (polarisation and delocalisation) were revealed and compared. Biological activity of thiazides has been found to depend on many factors, but mainly on the physico-chemical properties whose assessment was possible on the basis of electron density determination in the molecules performed by experimental and theoretical methods.

  9. Electron spin resonance studies on PS, PP and PS/PP blends under gamma irradiation

    Energy Technology Data Exchange (ETDEWEB)

    Reyes, Jacobo E-mail: reyesj@camelot.rect.ucv.ve; Albano, Carmen E-mail: calbano@ivic.vealbanoc@camelot.rect.ucv.ve; Claro, Marjorie; Moronta, Delfin

    2003-06-01

    Electron spin resonance studies on polystyrene (PS), polypropylene (PP) and on 80/20 PS/PP blends with and without compatibilizer (block SBS), at 7.5 wt%, irradiated with gamma rays from a {sup 60}Co source at a dose rate of 4.8 kGy/h and at integral irradiation doses of 10, 25, 50, 60, 70, 400, 800 and 1300 kGy in the presence of air and at room temperature are reported. Dependence of resonance line width, Hpp, resonance line shapes, K, and resonance line intensity, Ipp, on the integral dose of irradiation is investigated. Nature of free radicals after 10 days of air storage is discussed.

  10. Methyl Quantum Tunneling and NITROGEN-14 Nqr Studies Using a DC SQUID Magnetic Resonance Spectrometer.

    Science.gov (United States)

    Black, Bruce Elmer

    Nuclear Magnetic Resonance (NMR) and Nuclear Quadrupole Resonance (NQR) techniques have been very successful in obtaining molecular conformation and dynamics information. Unfortunately, standard NMR and NQR spectrometers are unable to adequately detect resonances below a few megahertz due to the frequency dependent sensitivity of their Faraday coil detectors. For this reason a new spectrometer with a dc SQUID (Superconducting Quantum Interference Device) detector, which has no such frequency dependence, has been developed. Previously, this spectrometer was used to observe ^ {11}B and ^{27} Al NQR resonances. I have increased the scope of this study to include ^{23}Na, ^{51}V, and ^ {55}Mn NQR transitions. Also, I present a technique to observe ^{14}N NQR resonances through cross relaxation of the nitrogen polarization to adjacent proton spins. When the proton Zeeman splitting matches one nitrogen quadrupolar transition the remaining two ^ {14}N transitions can be detected by sweeping a saturating rf field through resonance. Additionally, simultaneous excitation of two nitrogen resonances provides signal enhancement which helps to connect transitions from the same site. In this way, we have observed nitrogen -14 resonances in several amino acids and polypeptides. This spectrometer has also been useful in the direct detection of methyl quantum tunneling splittings at 4.2 K. Tunneling frequencies of a homologous series of carboxylic acids were measured and for solids with equivalent crystal structures, an exponential correlation between the tunneling frequency and the enthalpy of fusion is observed. This correlation provides information about the contribution of intermolecular interactions to the energy barrier for methyl rotation.

  11. Study of node and mass sensitivity of resonant mode based cantilevers with concentrated mass loading

    Directory of Open Access Journals (Sweden)

    Kewei Zhang

    2015-12-01

    Full Text Available Resonant-mode based cantilevers are an important type of acoustic wave based mass-sensing devices. In this work, the governing vibration equation of a bi-layer resonant-mode based cantilever attached with concentrated mass is established by using a modal analysis method. The effects of resonance modes and mass loading conditions on nodes and mass sensitivity of the cantilever were theoretically studied. The results suggested that the node did not shift when concentrated mass was loaded on a specific position. Mass sensitivity of the cantilever was linearly proportional to the square of the point displacement at the mass loading position for all the resonance modes. For the first resonance mode, when mass loading position xc satisfied 0 < xc < ∼ 0.3l (l is the cantilever beam length and 0 represents the rigid end, mass sensitivity decreased as the mass increasing while the opposite trend was obtained when mass loading satisfied ∼0.3l ≤ xc ≤ l. Mass sensitivity did not change when concentrated mass was loaded at the rigid end. This work can provide scientific guidance to optimize the mass sensitivity of a resonant-mode based cantilever.

  12. Conformational and membrane interaction studies of the antimicrobial peptide alyteserin-1c and its analogue [E4K]alyteserin-1c.

    Science.gov (United States)

    Subasinghage, Anusha P; O'Flynn, Donal; Conlon, J Michael; Hewage, Chandralal M

    2011-08-01

    Alyteserin-1c (GLKEIFKAGLGSLVKGIAAHVAS.NH(2)), first isolated from skin secretions of the midwife toad Alytes obstetricans, shows selective growth-inhibitory activity against Gram-negative bacteria. The structures of alyteserin-1c and its more potent and less haemolytic analogue [E4K]alyteserin-1c were investigated in various solution and membrane mimicking environments by proton NMR spectroscopy and molecular modelling. In aqueous solution, the peptide displays a lack of secondary structure but, in a 2,2,2-trifluoroethanol (TFE-d(3))-H(2)O solvent mixture, the structure is characterised by an extended alpha helix between residues Leu(2) and Val(21). Solution structural studies in the membrane mimicking environments, sodium dodecyl sulphate (SDS), dodecylphosphocholine (DPC), and 1,2-dihexanoyl-sn-glycero-3-phosphatidylcholine (DHPC) micelles, indicate that these peptides display an alpha helical structure between residues Lys(3) and Val(21). Positional studies of the peptides in SDS, DPC and DHPC media show that the N-terminal and central residues lie inside the micelle while C-terminal residues beyond Ala(19) do not interact with the micelles.

  13. Studies on yeast nucleoside triphosphate-nucleoside diphosphate transphosphorylase (nucleoside diphosphokinase). IV. Steady-state kinetic properties with thymidine nucleotides (including 3'-azido-3'-deoxythymidine analogues).

    Science.gov (United States)

    Kuby, S A; Fleming, G; Alber, T; Richardson, D; Takenaka, H; Hamada, M

    1991-01-01

    A study of the steady-state kinetics of the crystalline brewer's yeast (Saccharomyces carlsbergensis) nucleoside diphosphokinase, with the magnesium complexes of the adenine and thymidine nucleotides as reactants, has led to a postulated kinetic mechanism which proceeds through a substituted enzyme. This agrees with the earlier conclusions of Garces and Cleland [Biochemistry 1969; 8:633-640] who characterized a reaction between the magnesium complexes of the adenine and uridine nucleotides. An advantage of using thymidine nucleotides as reactants is that they permit accurate, rapid and continuous assays of the enzymatic activity in coupled-enzymatic tests. Through measurements of the initial velocities and product inhibition studies, the Michaelis constants, maximum velocities, and inhibition constants could be evaluated for the individual substrates. Competitive substrate inhibition was encountered at relatively high substrate concentrations, which also permitted an evaluation of their ability to act as 'dead-end' inhibitors. The Michaelis constants for the 3'-azido-3'-deoxythymidine (AzT) analogues were also evaluated and, although these values were only somewhat higher than those of their natural substrates, the Km's for the adenine nucleotides as paired substrates were lower and the Vmax's were drastically reduced. The pharmacological implications of these observations are touched upon and extrapolated to the cases where therapeutic doses of AzT may be employed.

  14. The Risk of Severe Hypoglycemia in Patients with Type 2 Diabetes Mellitus Starting Insulin Therapy with Premixed Insulin Analogues Taken Twice Daily: An Observational Study in Turkish Patients

    Directory of Open Access Journals (Sweden)

    Mustafa Sait Gönen

    2013-12-01

    Full Text Available Purpose: To assess the risk of severe hypoglycemia in Turkish patients with type 2 diabetes mellitus (T2DM starting insulin therapy with premixed insulin analogues alone or in combination with oral antihyperglycemic medications. Material and Method: Data from a subset of Turkish patients who participated in a 1-year, multinational, multicenter, prospective observational study were evaluated. Insulin treatment was initiated using commonly prescribed premixed regimens: insulin lispro mix 25 (25% insulin lispro, 75% insulin lispro protamine suspension or biphasic insulin aspart 30/70 (30% insulin aspart, 70% insulin aspart protamine suspension twice daily. Results: Of the 154 patients treated, 61 (39.6% were male with a mean age of 56 years and a T2DM duration of 8.9 years. Twelve patients (7.8% experienced ≥1 episode of severe hypoglycemia, but all recovered. The severe hypoglycemic rate was 0.14 episodes/patient-year. The mean glycated hemoglobin decreased by 2.7% (10.4% to 7.8% and fasting plasma glucose by 115.9 mg/dL (265.3 mg/dL to 157.6 mg/dL (p<0.0001. Self-monitored blood glucose (2-hour post morning meal decreased by 163.3 mg/dL (327.0 mg/dL to 216.2 mg/dL; p<0.0001. Self-monitored blood glucose level was low, particularly at the 2-hour post evening meal. Body mass index increased by 1.4 kg/m2, and total daily insulin dose by 4.2 IU. Discussion: In Turkish patients with T2DM, initiation of premixed insulin analogues during routine clinical care significantly improves glycemic control during the first year of treatment, but comes with a risk for severe hypoglycemia. Improvements in physician and patient education within the Turkish population regarding hypoglycemia management may be of benefit. Turk Jem 2013; 17: 83-8

  15. A Short Term Analogue Memory

    DEFF Research Database (Denmark)

    Shah, Peter Jivan

    1992-01-01

    A short term analogue memory is described. It is based on a well-known sample-hold topology in which leakage currents have been minimized partly by circuit design and partly by layout techniques. Measurements on a test chip implemented in a standard 2.4 micron analogue CMOS process show a droop...

  16. Modeling quantum mechanical scattering with continuous analogue of the newton method

    Directory of Open Access Journals (Sweden)

    Algirdas Deveikis

    2013-09-01

    Full Text Available Computational modelling of potential and resonant scattering for short range and Coulomb potentials was investigated in this study. The resonant scattering problem is formulated with the short range potential composed of a spherically symmetric square well and spherically symmetric square barrier. An iteration scheme of a continuous analogue of the Newton method for continuous spectral problem with correct asymptotic in uncoupled partial waves has been developed. The nonlinear representation of the scattering problem for the normalized radial Schrödinger equation is solved numerically using the difference sweep technique. The second order accuracy scheme developed allow to find scattering phases and wave functions as well as investigate their numerical evolution. The scattering phases and wave functions dependence on the scattering problem parameters have been studied.

  17. Vorticity in analogue gravity

    CERN Document Server

    Cropp, Bethan; Turcati, Rodrigo

    2015-01-01

    In the analogue gravity framework, the acoustic disturbances in a moving fluid can be described by an equation of motion identical to a relativistic scalar massless field propagating in a curved spacetime. This description is possible only when the fluid under consideration is barotropic, inviscid and irrotational. In this case, the propagation of the perturbations is governed by an acoustic metric which depends algebrically on the local speed of sound, density and the background flow velocity, the latter assumed to be vorticity free. In this work we provide an straightforward extension in order to go beyond the irrotational constraint. Using a charged --- relativistic and non-relativistic --- Bose--Einstein condensate as a physical system, we show that in the low momentum limit and performing the eikonal approximation we can derive a d'Alembertian equation of motion for the charged phonons where the emergent acoustic metric depends on a flow velocity in the presence of vorticity.

  18. An abundance study of the solar-analogue, CoRoT targets HD 42618 and HD 43587 from HARPS spectroscopy

    CERN Document Server

    Morel, T; Poretti, E; Barban, C; Boumier, P

    2013-01-01

    We present a detailed abundance study based on spectroscopic data obtained with HARPS of two solar-analogue, main targets for the asteroseismology programme of the CoRoT satellite: HD 42618 and HD 43587. The atmospheric parameters and chemical composition are accurately determined through a fully differential analysis with respect to the Sun observed with the same instrumental set-up. Several sources of systematic errors largely cancel out with such an approach, allowing us to narrow down the 1-sigma error bars to typically 20 K in effective temperature, 0.04 dex in surface gravity and less than 0.05 dex in the elemental abundances. Although HD 42618 fulfills many requirements for being classified as a solar twin, its slight deficiency in metals and possibly younger age indicate that, strictly speaking, it does not belong to this class of objects. On the other hand, HD 43587 is slightly more massive and evolved. In addition, marked differences are found in the amount of lithium present in the photospheres of ...

  19. Novel lavendamycin analogues as antitumor agents: synthesis, in vitro cytotoxicity, structure-metabolism, and computational molecular modeling studies with NAD(P)H:quinone oxidoreductase 1.

    Science.gov (United States)

    Hassani, Mary; Cai, Wen; Holley, David C; Lineswala, Jayana P; Maharjan, Babu R; Ebrahimian, G Reza; Seradj, Hassan; Stocksdale, Mark G; Mohammadi, Farahnaz; Marvin, Christopher C; Gerdes, John M; Beall, Howard D; Behforouz, Mohammad

    2005-12-01

    Novel lavendamycin analogues with various substituents were synthesized and evaluated as potential NAD(P)H:quinone oxidoreductase (NQO1)-directed antitumor agents. Pictet-Spengler condensation of quinoline- or quninoline-5,8-dione aldehydes with tryptamine or tryptophans yielded the lavendamycins. Metabolism studies with recombinant human NQO1 revealed that addition of NH2 and CH2OH groups at the quinolinedione-7-position and indolopyridine-2'-position had the greatest positive impact on substrate specificity. The best and poorest substrates were 37 (2'-CH2OH-7-NH2 derivative) and 31 (2'-CONH2-7-NHCOC3H7-n derivative) with reduction rates of 263 +/- 30 and 0.1 +/- 0.1 micromol/min/mg NQO1, respectively. Cytotoxicity toward human colon adenocarcinoma cells was determined for the lavendamycins. The best substrates for NQO1 were also the most selectively toxic to the NQO1-rich BE-NQ cells compared to NQO1-deficient BE-WT cells with 37 as the most selective. Molecular docking supported a model in which the best substrates were capable of efficient hydrogen-bonding interactions with key residues of the active site along with hydride ion reception.

  20. Comparative study of bisphenol A and its analogue bisphenol S on human hepatic cells: a focus on their potential involvement in nonalcoholic fatty liver disease.

    Science.gov (United States)

    Peyre, Ludovic; Rouimi, Patrick; de Sousa, Georges; Héliès-Toussaint, Cécile; Carré, Benjamin; Barcellini, Sylvie; Chagnon, Marie-Christine; Rahmani, Roger

    2014-08-01

    For several decades, people have been in contact with bisphenol A (BPA) primarily through their diet. Nowadays it is gradually replaced by an analogue, bisphenol S (BPS). In this study, we compared the effects of these two bisphenols in parallel with the positive control diethylstilbestrol (DES) on different hepatocyte cell lines. Using a cellular impedance system we have shown that BPS is less cytotoxic than BPA in acute and chronic conditions. We have also demonstrated that, contrary to BPA, BPS is not able to induce an increase in intracellular lipid and does not activate the PXR receptor which is known to be involved in part, in this process. In parallel, it failed to modulate the expression of CYP3A4 and CYP2B6, the drug transporter ABCB1 and other lipid metabolism genes (FASN, PLIN). However, it appears to have a weak effect on GSTA4 protein expression and on the Erk1/2 pathway. In conclusion, in contrast to BPA, BPS does not appear to induce the metabolic syndrome that may lead to non-alcoholic fatty liver disease (NAFLD), in vitro. Although we have to pay special attention to BPS, its use could be less dangerous concerning this toxicological endpoint for human health.

  1. Ce(IV)- and light-driven water oxidation by [Ru(terpy)(pic)3]2+ analogues: catalytic and mechanistic studies.

    Science.gov (United States)

    Duan, Lele; Xu, Yunhua; Tong, Lianpeng; Sun, Licheng

    2011-02-18

    A series of mononuclear ruthenium polypyridyl complexes [Ru(Mebimpy)(pic)(3)](PF(6))(2) (2; Mebimpy = 2,6-bis(1-methylbenzimidazol-2-yl)pyridine; pic = 4-picoline), Ru(bimpy)(pic)(3) (3; H(2)bimpy = 2,6-bis(benzimidazol-2-yl)pyridine), trans-[Ru(terpy)(pic)(2)Cl](PF(6)) (4; terpy = 2,2';6',2"-terpyridine), and trans-[Ru(terpy)(pic)(2)(OH(2))](ClO(4))(2) (5) are synthesized and characterized as analogues of the known Ru complex, [Ru(terpy)(pic)(3)](PF(6))(2) (1). The effect of the ligands on electronic and catalytic properties is studied and discussed. The negatively charged ligand, bimpy(2-), has a remarkable influence on the electrochemical events due to its strong electron-donating ability. The performance in light- and Ce(IV)-driven (Ce(IV) = Ce(NH(4))(2)(NO(3))(6)) water oxidation is successfully demonstrated. We propose that ligand exchange between pic and H(2)O occurs to form the real catalyst, a Ru-aqua complex. The synthesis and testing of trans-[Ru(terpy)(pic)(2)(OH(2))](ClO(4))(2) (5) confirmed our proposal. In addition, complex 5 possesses the best catalytic activity among these five complexes.

  2. Study on Dielectric Function Models for Surface Plasmon Resonance Structure

    Directory of Open Access Journals (Sweden)

    Peyman Jahanshahi

    2014-01-01

    Full Text Available The most common permittivity function models are compared and identifying the best model for further studies is desired. For this study, simulations using several different models and an analytical analysis on a practical surface Plasmon structure were done with an accuracy of ∼94.4% with respect to experimental data. Finite element method, combined with dielectric properties extracted from the Brendel-Bormann function model, was utilized, the latter being chosen from a comparative study on four available models.

  3. A study of dark resonance splitting for the D 1 line of 87Rb in strong magnetic fields

    Science.gov (United States)

    Sargsyan, A.; Mirzoyan, R.; Sarkisyan, D.

    2012-11-01

    The process of electromagnetically induced transparency (EIT) is studied using an extremely thin cell with thickness of a vapor column of rubidium atoms L = 794 nm. Wavelengths of resonant laser beams λ ≈ 794 nm. Results of the study of behavior of the EIT resonance (which is also called the "dark" resonance) formed in the Л system of the D 1 line of 87Rb atoms in strong magnetic fields up to 1700 G (0.17 T) are reported for the first time. Three dark resonances are recorded in magnetic fields with induction B 650 G, and only one dark resonance is retained at B > 1200 G. A method of the formation of a dark resonance at a given frequency is demonstrated that will allow, under the corresponding conditions, the formation of a dark resonance also at B > 0.2 T. The experimental results are well described by the known theoretical models. Practical applications of these results are indicated.

  4. Study of Intrinsic Dissipation Due to Thermoelastic Coupling in Gyroscope Resonators.

    Science.gov (United States)

    Li, Changlong; Gao, Shiqiao; Niu, Shaohua; Liu, Haipeng

    2016-01-01

    This paper presents analytical models, as well as numerical and experimental verification of intrinsic dissipation due to thermoelastic loss in tuning-fork resonator. The thermoelastic analytical governing equations are created for resonator vibrating at drive-mode and sense-mode, and thermoelastic vibration field quantities are deduced. Moreover, the theoretical values are verified that coincided well with finite element analysis (FEM) simulation results. Also, the comparison of vibration field quantities is made to investigate the effect of different conditions on resonator thermoelastic vibration behavior. The significant parameters of thermoelastic damping and quality factor are subsequently deduced to analyze the energy dissipation situation in the vibration process. Meanwhile, the corresponding conclusions from other studies are used to verify our theoretical model and numerical results. By comparing with the experimental quality factor, the numerical values are validated. The combination of the theoretical expressions, numerical results and experimental data leads to an important insight into the achievable quality factor value of tuning-fork resonator, namely, that the thermoelastic damping is the main loss mechanism in the micro-comb finger structure and the quality factor varies under different vibration modes. The results demonstrate that the critical geometry dimensions of tuning-fork resonator can be well designed with the assistance of this study.

  5. New experimental study of low-energy (p,gamma) resonances in magnesium isotopes

    CERN Document Server

    Limata, B; Formicola, A; Imbriani, G; Junker, M; Becker, H W; Bemmerer, D; Best, A; Bonetti, R; Broggini, C; Caciolli, A; Corvisiero, P; Costantini, H; DiLeva, A; Elekes, Z; Fülöp, Zs; Gervino, G; Guglielmetti, A; Gustavino, C; Gyürky, Gy; Lemut, A; Marta, M; Mazzocchi, C; Menegazzo, R; Prati, P; Roca, V; Rolfs, C; Alvarez, C Rossi; Salvo, C; Somorjai, E; Straniero, O; Terrasi, F; Trautvetter, H -P

    2010-01-01

    Proton captures on Mg isotopes play an important role in the Mg-Al cycle active in stellar H shell burning. In particular, the strengths of low-energy resonances with E < 200 keV in 25Mg(p,gamma)26Al determine the production of 26Al and a precise knowledge of these nuclear data is highly desirable. Absolute measurements at such low-energies are often very difficult and hampered by gamma-ray background as well as changing target stoichiometry during the measurements. The latter problem can be partly avoided using higher energy resonances of the same reaction as a normalization reference. Hence the parameters of suitable resonances have to be studied with adequate precision. In the present work we report on new measurements of the resonance strengths omega_gamma of the E = 214, 304, and 326 keV resonances in the reactions 24Mg(p,gamma)25Al, 25Mg(p,gamma)26Al, and 26Mg(p,gamma)27Al, respectively. These studies were performed at the LUNA facility in the Gran Sasso underground laboratory using multiple experime...

  6. Psychosis and autism: magnetic resonance imaging study of brain anatomy.

    LENUS (Irish Health Repository)

    Toal, Fiona

    2009-05-01

    Autism-spectrum disorder is increasingly recognised, with recent studies estimating that 1% of children in South London are affected. However, the biology of comorbid mental health problems in people with autism-spectrum disorder is poorly understood.

  7. Nuclear magnetic resonance study of thermal oxidation of polyisoprene

    Science.gov (United States)

    Golub, M. A.; Hsu, M. S.

    1975-01-01

    An investigation was conducted concerning the microstructural changes occurring in cis- and trans-1,4-polyisoprenes during uncatalized thermal oxidation in the solid phase. The investigation made use of approaches based on proton and carbon-13 NMR spectroscopy. The oxidation of squalene and dihydromyrcene in the liquid phase was also studied. The studies provide the first NMR spectroscopic evidence for the presence of epoxy and peroxide, hydroperoxide, and alcohol groups within the oxidized polyisoprene chain.

  8. Influence of GnRH analogue on body mass index in girls with precocious puberty: a prospective study

    Directory of Open Access Journals (Sweden)

    Heshmat Moaieri

    2014-06-01

    Conclusion: Gonadotropin-releasing hormone analog (GnRHa therapy in central precocious puberty (CPP is safe for BMI and increasing of BMI is not significant, long- term follow-up study is required to elucidate whether GnRHa treatment affects adult obesity. Using growth hormone concomitantly, the effect on increasing height is significant.

  9. Nuclear magnetic resonance studies on bentonite in complex mixed systems

    OpenAIRE

    2012-01-01

    In this work 23Na MAS NMR was validated as a successful quantitative method for studies of exchanging sodium in bentonites useful, in particular, for studies of ion-exchange kinetics. Na-enriched bentonites equilibrated in a re-circulated process water at iron-oxide pelletizing plants may acquire properties of Ca-bentonites after already 20 minutes of the equilibration time, since >50 % of sodium ions will be exchanged by calcium ions during first minutes of bentonite placed in contact wit...

  10. 3D-QSAR Study on Diindolylmethane and Its Analogues with Comparative Molecular Field Analysis (CoMFA)

    Institute of Scientific and Technical Information of China (English)

    BENABADJI,Sakina Hayat; CHEN,Hai-Feng; YUAN,Shen-Gang; WEN,Ren

    2003-01-01

    Comparative molecular field analysis (CoMFA), a three dimensional quantitative structure-activity relationship (3D-QSAR)method was applied to a series of diindolylmethane(DIM) analogs to study the relationship between their structure and theirinnduction of CYP 1A1-associated ethoxyresorufin-O-deethylase (EROD) activity. A DISCO model of pharmacophore was derived to guide the superposition of the compounds. The coefficient of cross-validation (p2) and non cross-validation (r2) for the model established by the study are 0.827 and 0.988 respectively, the value of variance ratio(F) is 103.53 and standard error estimate (SEE) is 0.044. These values indicate that the CoMFA model derived is significant and might have a good prediction for the catalytic activity of DIM compound. As a consequence, the predicted activity values of new designed compounds were all higher than that of the reported value.

  11. A theoretical study of a ZnO graphene analogue: adsorption on Ag(111) and hydrogen transport

    Energy Technology Data Exchange (ETDEWEB)

    Demiroglu, Ilker; Illas, Francesc; Bromley, Stefan T [Department de Quimica Fisica and Institut de Quimica Teorica i Computacional (IQTCUB), Universitat de Barcelona (UB), C/MartI i Franques 1, E-08028 Barcelona (Spain); Stradi, Daniele, E-mail: s.bromley@ub.edu [Departamento de Quimica, Universidad Autonoma de Madrid, Ciudad Universitaria de Cantoblanco, E-28049 Madrid (Spain)

    2011-08-24

    A single sheet of zinc oxide (ZnO) based on the same flat two-dimensional (2D) hexagonal topology as graphene, but with alternating neighbouring Zn and O atoms in place of carbon atoms, is studied theoretically. Following experimental studies, the adsorption of 2D-ZnO with the Ag(111) surface is investigated using density functional theory, with and without a semi-empirical correction for dispersive interactions, and with classical interatomic potentials. The interaction of H atoms with the hexagonal Zn{sub 3}O{sub 3} rings of 2D-ZnO is given special attention where multi-centre bond formation is observed to significantly assist the transport of H atoms through the 2D-ZnO sheet.

  12. A theoretical study of a ZnO graphene analogue: adsorption on Ag(111) and hydrogen transport.

    Science.gov (United States)

    Demiroglu, Ilker; Stradi, Daniele; Illas, Francesc; Bromley, Stefan T

    2011-08-24

    A single sheet of zinc oxide (ZnO) based on the same flat two-dimensional (2D) hexagonal topology as graphene, but with alternating neighbouring Zn and O atoms in place of carbon atoms, is studied theoretically. Following experimental studies, the adsorption of 2D-ZnO with the Ag(111) surface is investigated using density functional theory, with and without a semi-empirical correction for dispersive interactions, and with classical interatomic potentials. The interaction of H atoms with the hexagonal Zn(3)O(3) rings of 2D-ZnO is given special attention where multi-centre bond formation is observed to significantly assist the transport of H atoms through the 2D-ZnO sheet.

  13. Pharmacophore modeling and 3D-QSAR studies on substituted benzothiazole / benzimidazole analogues as DHFR inhibitors with antimycobacterial activity

    Directory of Open Access Journals (Sweden)

    R. Priyadarsini

    2012-08-01

    Full Text Available The resurgence of tuberculosis and the emergence of multidrug-resistant strains of Mycobacteria drugs has propelled the development of new structural classes of antitubercular agents. The present study was undertaken to investigate the opportunities which the enzyme dihydrofolate reductase, a promising drug target for treatmentof Mycobacterial infections offers for the development of new TB drugs. Pharmacophore models were established by using the HipHop and HypoGen algorithms implemented in the Catalyst software package. Thebest quantitative pharmacophore model, consisted of two hydrogen bond acceptor, a hydrophobic aliphatic, and a ring aromatic feature which has the highest correlation coefficient (0.93, as well as enrichment factor of 1.75 and Goodness of hit score of 0.73. Based on the pharmacophore model some leads were optimized and some of its derivatives were synthesized and analysed by following QSAR studies. About 25 compounds of substituted benzothiazole/ benzimidazole derivatives were synthesized as potent DHFR inhibitors and screened for antimycobacterial activity. To further explore the structure-activity relationships of all newly synthesized compounds, 3D-QSAR analyses were developed. MFA studies were performed with the QSAR module of Cerius2 using genetic partial least squares (G/PLS algorithm. The predictive ability of the developed model was assessed using a training set of 25 and a test set of 5 compounds (r2pred = 0.924.The analyzed MF

  14. Comparative study of resonant and sequential features in electron field emission from composite surfaces

    Energy Technology Data Exchange (ETDEWEB)

    Filip, Valeriu, E-mail: vfilip@gmail.com [Faculty of Physics, University of Bucharest, 405 Atomistilor Str., Magurele 077125, P.O. Box MG-11 (Romania); Institute of Microelectronics and Photonics, Zhejiang University, 38 Zheda Road, Hangzhou 310027 (China); Wong, Hei, E-mail: xiwang@zju.edu.cn [Institute of Microelectronics and Photonics, Zhejiang University, 38 Zheda Road, Hangzhou 310027 (China)

    2016-06-01

    A simple model of a layered hetero-structure was developed and used to simultaneously compute and compare resonant and sequential electron field emission currents. It was found that, while various slope changes appear in both current-field characteristics, for the sequential tunneling type of emission, such features are merely interference effects. They occur in parts of the structure, prior to the electrons' lingering in the quasi-bound states from which field emission proceeds. These purely quantum effects further combine with the flow effects resulting from the steady current requirement and give corresponding field variations of the electron population of the quasi-bound states, which further react on the resonant part of the current. A spectral approach of the two types of field emission is also considered by computing the total energy distribution of electrons in each case. The differences between these possible spectra are pointed out and discussed. - Highlights: • The relationship between resonant and sequential field emission is studied. • Sequential current–voltage characteristics show barrier-controlled undulations. • Resonant characteristics depend mainly on the width/shape of the topmost well. • The resonant and sequential total energy distributions differ widely.

  15. T-forbidden excitation of isobaric analogue states in the 37Cl(p, α0)34S reaction

    NARCIS (Netherlands)

    Bosnjakovic, B.; Leun, C. van der

    1966-01-01

    The analogues of the two lowest levels of 38Cl, with Jπ=3- and 5-, were excited in the T-forbidden reaction 37Cl(p, αo)34S. The Jπ=3- analogue state is split into several components which form a micro-giant resonance.

  16. Synthesis of novel 2-(4-(2-morpholinoethoxy)phenyl)-N-phenylacetamide analogues and their antimicrobial study

    Indian Academy of Sciences (India)

    H P Jayadevappa; G Nagendrappa; S Umesh; S Chandrashekar

    2012-09-01

    A new class of potential biologically active 2-(4-(2-morpholinoethoxy)phenyl)-N-phenylacetamides has been synthesized from hydroxyphenylacetic acid. The products were characterized through IR, 1H NMR, mass spectral studies and elemental analysis. The compounds were screened for antimicrobial activity by disc agar diffusion technique. The potency of compounds is tested against variety of fungal and bacterial strains in comparison to clotrimazole and streptomycin, respectively. Some of the synthesized compounds exhibit superior in vitro activity compared to the standard drugs.

  17. Cafestol to Tricalysiolide B and Oxidized Analogues: Biosynthetic and Derivatization Studies Using Non-heme Iron Catalyst Fe(PDP).

    Science.gov (United States)

    Bigi, Marinus A; Liu, Peng; Zou, Lufeng; Houk, K N; White, M Christina

    2012-12-01

    The tricalysiolides are a recently isolated class of diterpene natural products featuring the carbon backbone of the well-known coffee extract, cafestol. Herein we validate the use of our non-heme iron complex, Fe(PDP), as an oxidative tailoring enzyme mimic to test the proposal that this class of natural products derives from cafestol via cytochrome P-450-mediated furan oxidation. Thereafter, as predicted by computational analysis, C-H oxidation derivatization studies provided a novel 2° alcohol product as a single diastereomer.

  18. STUDY OF BRAIN TUMOURS BY NOVE L MAGNETIC RESONANCE TECHNIQUE

    OpenAIRE

    Mohammad Shamim; Reyaz; Anju; Dinesh Kumar; Paricharak

    2015-01-01

    In the present study , thirty patients in the age range of 22 to 63 years of age were included after being diagnosed to be having brain tumour on CT scan or conventional MRI. In addition DWI , MRS , and PWI were carried out i n these patients. All the patients with suspicious malignant lesions were then subjected to FDG - PET examination . Histopathological correlation was obtained in all the patients to serve as gold standard against which other m...

  19. Human Factor Studies on a Mars Analogue During Crew 100b International Lunar Exploration Working Group EuroMoonMars Crew: Proposed New Approaches for Future Human Space and Interplanetary Missions.

    Science.gov (United States)

    Rai, Balwant; Kaur, Jasdeep

    2012-11-01

    Knowing the risks, costs, and complexities associated with human missions to Mars, analogue research can be a great (low-risk) tool for exploring the challenges associated with the preparation for living, operating, and undertaking research in interplanetary missions. Short-duration analogue studies, such as those being accomplished at the Mars Desert Research Station (MDRS), offer the chance to study mission operations and human factors in a simulated environment, and therefore contribute to exploration of the Moon and Mars in planned future missions. This article is based upon previously published articles, abstracts, and presentations by a series of independent authors, human factor studies performed on mars analogue station by Crew 100B. The MDRS Crew 100B performed studies over 15 days providing a unique insight into human factor issues in simulated short-duration Mars mission. In this study, 15 human factors were evaluated and analyzed by subjective and objective means, and from the summary of results it was concluded that optimum health of an individual and the crew as a whole is a necessity in order to encourage and maintain high performance and the satisfaction of project goals.

  20. Effects of gender-related domain violations and sexual orientation on perceptions of male and female targets: an analogue study.

    Science.gov (United States)

    Blashill, Aaron J; Powlishta, Kimberly K

    2012-10-01

    The current study examined factors that influenced heterosexual male and female raters' evaluations of male and female targets who were gay or heterosexual, and who displayed varying gender roles (i.e., typical vs. atypical) in multiple domains (i.e., activities, traits, and appearance). Participants were 305 undergraduate students from a private, midwestern Jesuit institution who read vignettes describing one of 24 target types and then rated the target on possession of positive and negative characteristics, psychological adjustment, and on measures reflecting the participants' anticipated behavior toward or comfort with the target. Results showed that gender atypical appearance and activity attributes (but not traits) were viewed more negatively than their gender typical counterparts. It was also found that male participants in particular viewed gay male targets as less desirable than lesbian and heterosexual male targets. These findings suggest a nuanced approach for understanding sexual prejudice, which incorporates a complex relationship among sex, gender, sexual orientation, and domain of gendered attributes.

  1. The gravitational analogue to the hydrogen atom (A summer study at the borders of quantum mechanics and general relativity)

    CERN Document Server

    Kober, M; Koch, B; Bleicher, Marcus; Kober, Martin; Koch, Ben

    2007-01-01

    This article reports on a student summer project performed in 2006 at the University of Frankfurt. It is addressed to undergraduate students familiar with the basic principles of relativistic quantum mechanics and general relativity. The aim of the project was to study the Dirac equation in curved space time. To obtain the general relativistic Dirac equation we use the formulation of gravity as a gauge theory in the first part. After these general considerations we restrict the further discussion to the special case of the Schwarzschild metric. This setting corresponds to the hydrogen atom, with the electromagnetic field replaced by gravity. Although there is a singularity at the event horizon it turns out that a regular solution of the time independent Dirac equation exists. Finally the Dirac equation is solved numerically using suitable boundary conditions.

  2. Formation of continuous metallic film on quartz studied by noncontact resonant ultrasound spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Nakamura, N., E-mail: nobutomo@me.es.osaka-u.ac.jp; Yoshimura, N.; Ogi, H.; Hirao, M. [Osaka University, Graduate School of Engineering Science, Toyonaka, Osaka 560-8531 (Japan)

    2015-08-28

    Dynamics of continuous film formation of metallic films on quartz substrates is studied using an electrodeless resonance method. Bare quartz is used as a substrate, and a metallic film is deposited on it. We use antenna transmission technique to measure the evolution of resonance frequencies and internal friction of the substrate during and after deposition, and the morphological transition between discontinuous islands and a continuous film is detected. By comparison with atomic force microscopy images, we confirm that the frequency drop and the internal-friction peak that appear during deposition indicate this transition. We also find that Pt film shows unexpected morphology change after deposition.

  3. Switching of transmission resonances in a two-channels coupler: A Boundary Wall Method scattering study

    Science.gov (United States)

    Nunes, A.; Zanetti, F. M.; Lyra, M. L.

    2016-10-01

    In this work, we study the transmission characteristics of a two-channels coupler model system using the Boundary Wall Method (BWM) to determine the solution of the corresponding scattering problem of an incident plane wave. We show that the BWM provides detailed information regarding the transmission resonances. In particular, we focus on the case of single channel input aiming to explore the energy switching performance of the coupler. We show that the coupler geometry can be tailored to allow for the first transmission resonances to be predominantly transmitted on specific output channels, an important characteristic for the realization of logical operations.

  4. Ferromagnetic resonance study of MnAs/GaAs(1 1 1) thin films

    Energy Technology Data Exchange (ETDEWEB)

    Repetto Llamazares, A.H.V. [CNEA - Centro Atomico Bariloche and Instituto Balseiro, UNCu (R8402AGP) San Carlos de Bariloche, Rio Negro (Argentina); Milano, J. [CNEA - Centro Atomico Bariloche and Instituto Balseiro, UNCu (R8402AGP) San Carlos de Bariloche, Rio Negro (Argentina)]. E-mail: milano@cab.cnea.gov.ar; Steren, L.B. [CNEA - Centro Atomico Bariloche and Instituto Balseiro, UNCu (R8402AGP) San Carlos de Bariloche, Rio Negro (Argentina); Garcia, V. [Institut des NanoSciences de Paris, UMR CNRS 7588, Universites Paris 6 et Paris 7, Campus Boucicaut - 140 rue de Lourmel - 75015 Paris (France); Marangolo, M. [Institut des NanoSciences de Paris, UMR CNRS 7588, Universites Paris 6 et Paris 7, Campus Boucicaut - 140 rue de Lourmel - 75015 Paris (France); Eddrief, M. [Institut des NanoSciences de Paris, UMR CNRS 7588, Universites Paris 6 et Paris 7, Campus Boucicaut - 140 rue de Lourmel - 75015 Paris (France); Etgens, V.H. [Institut des NanoSciences de Paris, UMR CNRS 7588, Universites Paris 6 et Paris 7, Campus Boucicaut - 140 rue de Lourmel - 75015 Paris (France)

    2007-09-01

    In this contribution we present a study of the magnetic properties of MnAs thin films grown over GaAs(1 1 1) substrates, performed by ferromagnetic resonance experiments. We have calculated the magneto-crystalline anisotropy of the system analyzing the angular dependence of the resonance field with the applied field direction. The anisotropy measured for these films is much smaller than the calculated for MnAs bulk samples and MnAs/GaAs(1 0 0) thin films. We propose different microscopic mechanism for addressing the change in the anisotropy.

  5. Angular dependent study on ferromagnetic resonance and spin excitations by spin rectification

    Energy Technology Data Exchange (ETDEWEB)

    Zhang, Yichao; Fan, Xiaolong, E-mail: fanxiaolong@lzu.edu.cn; Zhao, Xiaobing; Rao, Jinwei; Zhou, Hengan; Guo, Dangwei; Xue, Desheng [The Key Lab for Magnetism and Magnetic Materials of Ministry of Education, Lanzhou University, Lanzhou 730000 (China); Gui, Y. S.; Hu, C.-M. [Department of Physics and Astronomy, University of Manitoba, Winnipeg, Manitoba R3T 2N2 (Canada)

    2015-01-14

    We report angular dependent spin rectification spectra which are applied to studying spin excitations in single permalloy stripe. Based on planar Hall effect, those spin excitations generate special resonant dc Hall voltages, which have been characterized as functions of the amplitude and direction of applied magnetic field. Through high angular resolution 2D mappings, the evolutions of different spin excitation can be directly presented, and the dynamic magnetic parameters such as the gyromagnetic ratio, effective exchange field, as well as the quantized numbers of standing spin waves can be accurately determined through fitting the angular evolution of each resonance.

  6. A single particle plasmon resonance study of 3D conical nanoantennas.

    Science.gov (United States)

    Schäfer, Christian; Gollmer, Dominik A; Horrer, Andreas; Fulmes, Julia; Weber-Bargioni, Alexander; Cabrini, Stefano; Schuck, P James; Kern, Dieter P; Fleischer, Monika

    2013-09-07

    Metallic nanocones are well-suited optical antennas for near-field microscopy and spectroscopy, exhibiting a number of different plasmonic modes. A major challenge in using nanocones for many applications is maximizing the signal at the tip while minimizing the background from the base. It is shown that nanocone plasmon resonance properties can be shifted over a wide range of wavelengths by variation of the substrate, material, size and shape, enabling potential control over specific modes and field distributions. The individual resonances are identified and studied by correlated single particle dark field scattering and scanning electron microscopy in combination with numerical simulations.

  7. Toward an Enhancement of the Photoactivity of Multiphotochromic Dimers Using Plasmon Resonance: A Theoretical Study.

    Science.gov (United States)

    Fihey, Arnaud; Le Guennic, Boris; Jacquemin, Denis

    2015-08-06

    Building dimers of organic photochromic compounds paves the way to multifunctional switches, but such architectures often undergo partial photoreactivity only. Combining photochromism of molecules and plasmon resonance of gold nanoparticles (NPs) is known to affect the photochromism of monomers, yet the impact on multimers remains unknown. Here we propose a theoretical study of dimers of dithienylethenes by the mean of a hybrid calculation scheme (discrete-interaction model/quantum mechanics). We aim to assess how the optical properties of multiphotochromes are tuned by the influence of the plasmon resonances. We show that, for a typical chemisorption orientation on the NP, the absorption bands responsible for the photochromism are significantly enhanced for both the doubly open and mixed closed-open isomers of the dyad, hinting that plasmon resonance could be used to boost the generally poor photoactivity of dithienylethene dyads.

  8. Quadrature Slotted Surface Coil Pair for Magnetic Resonance Imaging at 4 Tesla: Phantom Study

    Directory of Open Access Journals (Sweden)

    Solis S.E.

    2012-01-01

    Full Text Available A coil array was composed of two slotted surface coils forming a structure with two plates at 900, each one having 6 circular slots and is introduced in this paper. Numerical simulations of the magnetic field of this coil array were performed at 170 MHz using the finite element method to study its behaviour. This coil array was developed for brain magnetic resonance imaging to be operated at the resonant frequency of 170 MHz in the transceiver mode and quadrature driven. Numerical simulations demonstrated that electromagnetic interaction between the coil elements is negligible, and that the magnetic field showed a good uniformity. Phantom images were acquired with our coil array and standard pulse sequences on a research-dedicated 4 Tesla scanner. In vitro images showed the feasibility of this coil array for standard pulses and high field magnetic resonance imaging.

  9. NATO Advanced Study Institute on Giant Resonances in Atoms, Molecules, and Solids

    CERN Document Server

    Esteva, J; Karnatak, R

    1987-01-01

    Often, a new area of science grows at the confines between recognised subject divisions, drawing upon techniques and intellectual perspectives from a diversity of fields. Such growth can remain unnoticed at first, until a characteristic fami ly of effects, described by appropriate key words, has developed, at which point a distinct subject is born. Such is very much the case with atomic 'giant resonances'. For a start, their name itself was borrowed from the field of nuclear collective resonances. The energy range in which they occur, at the juncture of the extreme UV and the soft X-rays, remains to this day a meeting point of two different experimental techniques: the grating and the crystal spectrometer. The impetus of synchrotron spectroscopy also played a large part in developing novel methods, described by many acronyms, which are used to study 'giant resonances' today. Finally, although we have described them as 'atomic' to differentiate them from their counterparts in Nuclear Physics, their occurrence ...

  10. Study of plasmon resonance in a gold nanorod with an LC circuit model

    CERN Document Server

    Huang, Cheng-ping; Huang, Huang; Zhu, Yong-yuan

    2009-01-01

    Gold nanorod has generated great research interest due to its tunable longitudinal plasmon resonance. However, little progress has been made in the understanding of the effect. A major reason is that, except for metallic spheres and ellipsoids, the interaction between light and nanoparticles is generally insoluble. In this paper, a new scheme has been proposed to study the plasmon resonance of gold nanorod, in which the nanorod is modeled as an LC circuit with an inductance and a capacitance. The obtained resonance wavelength is dependent on not only aspect ratio but also rod radius, suggesting the importance of self-inductance and the breakdown of linear scaling. Moreover, the cross sections for light scattering and absorption have been deduced analytically, giving rise to a Lorentzian line-shape for the extinction spectrum. The result provides us with new insight into the phenomenon.

  11. Experimental and analytical study of highly tunable electrostatically actuated resonant beams

    KAUST Repository

    Hajjaj, Amal Z.

    2015-11-03

    We demonstrate theoretically and experimentally highly tunable clamped–clamped microbeam resonators actuated with electrostatic forces. Theoretically, the Galerkin procedure is used to solve for static deflection as well as the eigenvalue problem as a function of the dc voltage for different values of the ratio between the air gap and the thickness of the microbeam. We demonstrate theoretically and experimentally that the natural frequency of the microbeam can increase or decrease with the increase of the dc polarization voltage depending on the ratio between the air gap and the thickness. Hence, we show that unlike the classical softening effect of the dc voltage, by careful designs of the microbeams, the dc bias can be used to effectively increase the resonance frequencies by several factors. Experimental data are presented for two case studies of silicon beams showing the effective increase of their fundamental resonance frequencies by more than 50–80%. Excellent agreement is reported among the theoretical and experimental results.

  12. Study of Antenna Superstrates Using Metamaterials for Directivity Enhancement Based on Fabry-Perot Resonant Cavity

    Directory of Open Access Journals (Sweden)

    Haixia Liu

    2013-01-01

    Full Text Available Metamaterial superstrate is a significant method to obtain high directivity of one or a few antennas. In this paper, the characteristics of directivity enhancement using different metamaterial structures as antenna superstrates, such as electromagnetic bandgap (EBG structures, frequency selective surface (FSS, and left-handed material (LHM, are unifiedly studied by applying the theory of Fabry-Perot (F-P resonant cavity. Focusing on the analysis of reflection phase and magnitude of superstrates in presently proposed designs, the essential reason for high-directivity antenna with different superstrates can be revealed in terms of the F-P resonant theory. Furthermore, a new design of the optimum reflection coefficient of superstrates for the maximum antenna directivity is proposed and validated. The optimum location of the LHM superstrate which is based on a refractive lens model can be determined by the F-P resonant distance.

  13. Experimental Study on LTCC Glass-Ceramic Based Dual Segment Cylindrical Dielectric Resonator Antenna

    Directory of Open Access Journals (Sweden)

    Ravi Kumar Gangwar

    2013-01-01

    Full Text Available The measured characteristics in C/X bands, including material properties of a dual segment cylindrical dielectric resonator antenna (CDRA fabricated from glass-ceramic material based on B2O3–La2O3–MgO glass and La(Mg0.5Ti0.5O3 ceramic, are reported. The sintering characteristic of the ceramic in presence of glass is determined from contact angle measurement and DTA. The return loss and input impedance versus frequency characteristics and radiation patterns of CDRA at its resonant frequency of 6.31 GHz are studied. The measured results for resonant frequency and return loss bandwidth of the CDRA are also compared with corresponding theoretical ones.

  14. Impact of nucleos(t)ide analogues on the estimated glomerular filtration rate in patients with chronic hepatitis B: a prospective cohort study in China.

    Science.gov (United States)

    Qi, X; Wang, J-Y; Mao, R-C; Zhang, J-M

    2015-01-01

    Chronic hepatitis B therapy with nucleos(t)ide analogues, particularly tenofovir or adefovir, may affect renal function. To date, there has not been a head-to-head controlled study to assess estimated glomerular filtration rate (eGFR) fluctuations in nucleos(t)ide-treated CHB patients. We aimed to evaluate the long-term effects of nucleos(t)ide on eGFR in Chinese patients with chronic hepatitis B. This prospective cohort study included 275 patients. Patient subgroups included those treated with lamivudine (n = 50), adefovir (n = 60), telbivudine (n = 68) and entecavir (n = 61); untreated patients (n = 36) served as control. After an average follow-up duration of 23 months, eGFR calculated by Cockcroft-Gault and Modification of Diet in Renal Disease formulas increased by 18.35 mL/min and 19.34 mL/min (P < 0.0001) in the telbivudine group, respectively, and decreased by 10.95 mL/min and 12.17 mL/min (P = 0.0001) in the adefovir group, respectively. Even if renal function was normal or mildly impaired at baseline, eGFR increased significantly more in the telbivudine group than in the other groups (P < 0.001). More patients in the adefovir group (23%) had a ≥20% decrease in eGFR than the other groups (P < 0.0001). More patients in the telbivudine group (31%) had a ≥20% increase in eGFR than the other groups (P < 0.0001). In conclusion, prolonged telbivudine therapy resulted in improved eGFR, while adefovir therapy was associated with decreased eGFR. Lamivudine and entecavir therapy did not significantly influence eGFR.

  15. Impact of a heteroatom in a structure-activity relationship study on analogues of phenyl glycidyl ether (PGE) from epoxy resin systems.

    Science.gov (United States)

    Niklasson, Ida B; Delaine, Tamara; Luthman, Kristina; Karlberg, Ann-Therese

    2011-04-18

    Epoxy resins are among the most common causes of occupational contact dermatitis. They are normally used in so-called epoxy resin systems (ERS). These commercial products are combinations of epoxy resins, curing agents, modifiers, and reactive diluents. The most frequently used resins are diglycidyl ethers based on bisphenol A (DGEBA) and bisphenol F (DGEBF). In this study, we have investigated the contact allergenic properties of a series of analogues to the reactive diluent phenyl glycidyl ether (PGE), all with similar basic structures but with varying heteroatoms or with no heteroatom present. The chemical reactivity of the compounds in the test series toward the hexapeptide H-Pro-His-Cys-Lys-Arg-Met-OH was investigated. All epoxides were shown to bind covalently to both cysteine and proline residues. The percent depletion of nonreacted peptide was also studied resulting in ca. 60% depletion when using either PGE, phenyl 2,3-epoxypropyl sulfide (2), or N-(2,3-epoxypropyl)aniline (3), and only 15% when using 1,2-epoxy-4-phenylbutane (4) at the same time point. The skin sensitization potencies of the epoxides using the murine local lymph node assay (LLNA) were evaluated in relation to the observed physicochemical and reactivity properties. To enable determination of statistical significance between structurally closely related compounds, a nonpooled LLNA was performed. It was found that all investigated compounds containing a heteroatom in the α-position to the epoxide were strong sensitizers, congruent with the reactivity data, indicating that the impact of a heteroatom is crucial for the sensitizing capacity for this type of epoxides.

  16. Quantitative structure-activity relationship and molecular docking studies of a series of quinazolinonyl analogues as inhibitors of gamma amino butyric acid aminotransferase

    Directory of Open Access Journals (Sweden)

    Usman Abdulfatai

    2017-01-01

    Full Text Available Quantitative structure-activity relationship and molecular docking studies were carried out on a series of quinazolinonyl analogues as anticonvulsant inhibitors. Density Functional Theory (DFT quantum chemical calculation method was used to find the optimized geometry of the anticonvulsants inhibitors. Four types of molecular descriptors were used to derive a quantitative relation between anticonvulsant activity and structural properties. The relevant molecular descriptors were selected by Genetic Function Algorithm (GFA. The best model was validated and found to be statistically significant with squared correlation coefficient (R2 of 0.934, adjusted squared correlation coefficient (R2adj value of 0.912, Leave one out (LOO cross validation coefficient (Q2 value of 0.8695 and the external validation (R2pred of 0.72. Docking analysis revealed that the best compound with the docking scores of −9.5 kcal/mol formed hydrophobic interaction and H-bonding with amino acid residues of gamma aminobutyric acid aminotransferase (GABAAT. This research has shown that the binding affinity generated was found to be better than the commercially sold anti-epilepsy drug, vigabatrin. Also, it was found to be better than the one reported by other researcher. Our QSAR model and molecular docking results corroborate with each other and propose the directions for the design of new inhibitors with better activity against GABAAT. The present study will help in rational drug design and synthesis of new selective GABAAT inhibitors with predetermined affinity and activity and provides valuable information for the understanding of interactions between GABAAT and the anticonvulsants inhibitors.

  17. Application of a fluorescent cobalamin analogue for analysis of the binding kinetics. A study employing recombinant human transcobalamin and intrinsic factor

    DEFF Research Database (Denmark)

    Fedosov, Sergey N; Grissom, Charles B; Fedosova, Natalya U;

    2006-01-01

    this behaviour. The most stable component had K(d) = 1.5 x 10(-13) m, which guarantees the binding of CBC to IF under physiological conditions. The specific intestinal receptor cubilin bound both IF-CBC and IF-Cbl with equal affinity. In conclusion, the fluorescent analogue CBC can be used as a reporting agent...

  18. A Patient Specific Biomechanical Analysis of Custom Root Analogue Implant Designs on Alveolar Bone Stress: A Finite Element Study

    Directory of Open Access Journals (Sweden)

    David Anssari Moin

    2016-01-01

    Full Text Available Objectives. The aim of this study was to analyse by means of FEA the influence of 5 custom RAI designs on stress distribution of peri-implant bone and to evaluate the impact on microdisplacement for a specific patient case. Materials and Methods. A 3D surface model of a RAI for the upper right canine was constructed from the cone beam computed tomography data of one patient. Subsequently, five (targeted press-fit design modification FE models with five congruent bone models were designed: “Standard,” “Prism,” “Fins,” “Plug,” and “Bulbs,” respectively. Preprocessor software was applied to mesh the models. Two loads were applied: an oblique force (300 N and a vertical force (150 N. Analysis was performed to evaluate stress distributions and deformed contact separation at the peri-implant region. Results. The lowest von Mises stress levels were numerically observed for the Plug design. The lowest levels of contact separation were measured in the Fins model followed by the Bulbs design. Conclusions. Within the limitations of the applied methodology, adding targeted press-fit geometry to the RAI standard design will have a positive effect on stress distribution, lower concentration of bone stress, and will provide a better primary stability for this patient specific case.

  19. Studies in vitro to discern the structural requirements for carcinogenicity in analogues of the carcinogen 4-dimethylaminoazobenzene (butter yellow).

    Science.gov (United States)

    Ashby, J; Styles, J A; Paton, D

    1980-01-01

    4-Dimethylaminoazobenzene (butter yellow, DAB), is the parent member of a large family of 'azo-carcinogens'. Experiments have been conducted in vitro to determine the key structural requirements for carcinogenic activity in this chemical class, and it is suggested, based on the activity observed for 4-cyano-N,N-dimethylaniline, that the 4-phenylazo group of DAB is not an essential structural feature per se. The N-oxide derivative of DAB has been evaluated in vitro and the positive response observed related to its metabolic activation. It is concluded that cyclic amines, such as pyrrolidine, can replace the N-dimethyl group of DAB with a retention of biological activity. The confusion that exists in the literature concerning the chemical identity and carcinogenic status of 2-dimethylaminobenzo[c]cinnoline has been investigated, and it is concluded that it is a potential animal carcinogen. This observation also indicates that the phenylazo group of DAB can be incorporated within an aromatic ring system with a retention of biological activity. As observed earlier with a mixture of azobenzene and DAB, azobenzene also potentiates the cell transforming properties of the above cinnoline derivative in vitro. Two charts are presented. The first attempts to integrate DAB within a much larger family of carcinogens, and the second illustrates the usefulness of structure-activity studies in general.

  20. Electron specific track fitters and Jpsi resonance studies in ATLAS

    CERN Document Server

    Cheatham, Susan

    This thesis discusses the reconstruction of J/psi to electron pairs based on fully simulated ATLAS Monte Carlo samples. A possible trigger strategy is described, taking advantage of the possible presence of a muon in the final state in bb production once one b-hadron decays into J/psi+X, followed by J/psi decay into e+e-. The tracks belonging to low-energy electrons are reconstructed using a dedicated algorithm, taking into account bremsstrahlung effects. The performance of this algorithm is compared with the other ATLAS track fitters and the potential of using this tracking algorithm to map the Inner Detector material is presented. The improvement in separation of indirect from prompt J/psi, by separately considering two kinematical configurations, `cowboys' and `sailors', is also presented, along with a feasibility study of measuring the ratio of indirect to prompt J/psi.

  1. Differentiation between stoichiometric and anticatalytic antioxidant properties of benzoic acid analogues: a structure/redox potential relationship study.

    Science.gov (United States)

    Franck, Thierry; Mouithys-Mickalad, Ange; Robert, Thierry; Ghitti, Gianangelo; Deby-Dupont, Ginette; Neven, Philippe; Serteyn, Didier

    2013-11-25

    We investigated the antioxidant activities of some phenolic acid derivatives on a cell free system and on cellular and enzymatic models involved in inflammation. The stoichiometric antioxidant activities of phenolic acid derivatives were studied by measuring their capacity to scavenge the radical cation 2,2'-azino-bis(3-ethylbenzothiazoline-6-sulphonic acid) (ABTS(+)) and reactive oxygen species (ROS) produced by stimulated neutrophils. The anticatalytic antioxidant capacity of the molecules was evaluated on the activity of myeloperoxidase (MPO), an oxidant enzyme present in and released by the primary granules of neutrophils. The ROS produced by PMA-stimulated neutrophils were measured by lucigenin-enhanced chemiluminescence (CL) and the potential interaction of the molecules with MPO was investigated without interferences due to medium by Specific Immuno-Extraction Followed by Enzyme Detection (SIEFED). The antioxidant activities of the phenolic compounds were correlated to their redox potentials measured by differential pulse voltammetry (DPV), and discussed in relation to their molecular structure. The ability of the phenolic molecules to scavenge ABTS radicals and ROS derived from neutrophils was inversely correlated to their increased redox potential. The number of hydroxyl groups (three) and their position (catechol) were essential for their efficacy as stoichiometric antioxidants or scavengers. On MPO activity, the inhibitory capacity of the molecules was not really correlated with their redox potential. Likewise, for the inhibition of MPO activity the number of OH groups and mainly the elongation of the carboxylic group were essential, probably by facilitating the interaction with the active site or the structure of the enzyme. The redox potential measurement, combined with ABTS and CL techniques, seems to be a good technique to select stoichiometric antioxidants but not anticatalytic ones, as seen for MPO, what rather involves a direct interaction with

  2. Magnetic Resonance Cardiorhythmography as a Method of Study of Human's Cardiovascular System Condition

    Science.gov (United States)

    Protasov, E. A.; Ryzhkova, A. V.

    In this article a highly sensitive method for graphic recording of cardiogram by detecting the signal of nuclear magnetic resonance (NMR) of human finger has been developed and signals directly related to movement of blood ejected by the heart into the vessels have been studied. Changes in the behavior of signals depending on the condition of the cardiovascular system of person have been discovered.

  3. Resonance Light-Scattering Spectroscopy Study on Interaction between Gold Colloid and Thiol Containing Pharmaceutical

    Institute of Scientific and Technical Information of China (English)

    Liu; Xiao-ling; Cai; Ru-xiu; 等

    2003-01-01

    In this paper, we used resonance light-scattering (RLS) spectroscopy to study the interaction betwwen thiolcontaining pharmaceutical and gold colloid. And for the first time, we proposed that this highly sensitive, gold colloidbased assay using RLS technique may have potential application in detecting thoil-containing substances.

  4. Resonance Light-Scattering Spectroscopy Study on Interaction between Gold Colloid and Thiol Containing Pharmaceutical

    Institute of Scientific and Technical Information of China (English)

    Liu Xiao-ling; Cai Ru-xiu; Yuan Hong

    2003-01-01

    In this paper, we used resonance light-scattering (RLS) spectroscopy to study the interaction between thiol-containing pharmaceutical and gold colloid. And for the first time, we proposed that this highly sensitive, gold colloid-based assay using RLS technique may have potential application in detecting thiol-containing substances.

  5. Nature of the pygmy dipole resonance in Ce-140 studied in (alpha, alpha 'gamma) experiments

    NARCIS (Netherlands)

    Savran, D.; Babilon, M.; van den Berg, A. M.; Harakeh, M. N.; Hasper, J.; Matic, A.; Wortche, H. J.; Zilges, A.

    2006-01-01

    A concentration of electric-dipole excitations below the particle threshold, which is frequently denoted as the pygmy dipole resonance, has been studied in the semimagic nucleus Ce-140 in (alpha, alpha(')gamma) experiments at E-alpha=136 MeV. The technique of alpha-gamma coincidence experiments allo

  6. Schwinger multichannel study of the 2Pi(g) shape resonance in N2

    Science.gov (United States)

    Huo, Winifred M.; Gibson, Thomas L.; Lima, Marco A. P.; Mckoy, Vincent

    1987-01-01

    The results of a study on electron-target correlations in the 2Pi(g) shape resonance of elastic e-N2 scattering, using the Schwinger multichannel formulation, are reported. The effects of basis set, orbital representation, and closed-channel-configurations are delineated. The different roles of radial and angular correlations are compared.

  7. Evaluation of relaxation time measurements by magnetic resonance imaging. A phantom study

    DEFF Research Database (Denmark)

    Kjaer, L; Thomsen, C; Henriksen, O;

    1987-01-01

    Several circumstances may explain the great variation in reported proton T1 and T2 relaxation times usually seen. This study was designed to evaluate the accuracy of relaxation time measurements by magnetic resonance imaging (MRI) operating at 1.5 tesla. Using a phantom of nine boxes with different...

  8. Defect-related internal dissipation in mechanical resonators and the study of coupled mechanical systems.

    Energy Technology Data Exchange (ETDEWEB)

    Friedmann, Thomas Aquinas; Czaplewski, David A.; Sullivan, John Patrick; Modine, Normand Arthur; Wendt, Joel Robert; Aslam, Dean (Michigan State University, Lansing, MI); Sepulveda-Alancastro, Nelson (University of Puerto Rico, Mayaguez, PR)

    2007-01-01

    Understanding internal dissipation in resonant mechanical systems at the micro- and nanoscale is of great technological and fundamental interest. Resonant mechanical systems are central to many sensor technologies, and microscale resonators form the basis of a variety of scanning probe microscopies. Furthermore, coupled resonant mechanical systems are of great utility for the study of complex dynamics in systems ranging from biology to electronics to photonics. In this work, we report the detailed experimental study of internal dissipation in micro- and nanomechanical oscillators fabricated from amorphous and crystalline diamond materials, atomistic modeling of dissipation in amorphous, defect-free, and defect-containing crystalline silicon, and experimental work on the properties of one-dimensional and two-dimensional coupled mechanical oscillator arrays. We have identified that internal dissipation in most micro- and nanoscale oscillators is limited by defect relaxation processes, with large differences in the nature of the defects as the local order of the material ranges from amorphous to crystalline. Atomistic simulations also showed a dominant role of defect relaxation processes in controlling internal dissipation. Our studies of one-dimensional and two-dimensional coupled oscillator arrays revealed that it is possible to create mechanical systems that should be ideal for the study of non-linear dynamics and localization.

  9. Studies on Interactions of Antibiotics with Serum Albumin by Surface Plasmon Resonance Biosensor

    Institute of Scientific and Technical Information of China (English)

    2006-01-01

    Characterizing how chemical compounds binding to serum albumin is essential in evaluating drug candidates and is the focus of this study. A surface plasmon resonance biosensor developed in this laboratory was used to determine the binding constants of antibiotics with serum albumin. The binding constants of five antibiotics(azithromycin, spectinomycin, gentamycin, metacycline and kanamycin) with serum albumins were obtained.

  10. Physicochemical analyses of a bioactive 4-aminoantipyrine analogue - synthesis, crystal structure, solid state interactions, antibacterial, conformational and docking studies

    Science.gov (United States)

    Alam, Mohammad Sayed; Lee, Dong-Ung

    2016-01-01

    A novel Schiff base derivative of 4-aminoantipyrine, that is, (E)-4-(2-methoxybenzylideneamino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one (MBA-dMPP), was synthesized and characterized by FT-IR, 1H-NMR, and EI-MS. Single-crystal X-ray diffraction data revealed MBA-dMPP adopts a trans configuration around its central C=N double bond, and forms orthorhombic crystals. XRD revealed that MBA-dMPP possess two different planes, in which the pyrazolone and benzylidene groups attached to C9 of the pyrazolone ring are almost coplanar and the phenyl ring connected to the N1 atom of the pyrazolone moiety lies in another plane. The intermolecular, host-guest C-H…O, C-H…N, and C-H…C van der Waals interactions were found to form a 3D network and confer stability to the MBA-dMPP crystal structure. The quantitative and qualitative solid state behaviors of MBA-dMPP were subjected to 3D Hirshfeld surface analysis and 2D fingerprint plotting. Reciprocal H…H contacts contributed most (52.9 %) to the Hirshfeld surface, followed by C…H/H…C contacts (30.2 %), whereas, O…H/H…O and N…H/H…N interactions contributed 15.5 % to the Hirshfeld surface. Electrostatic potentials were mapped over the Hirshfeld surface to analyze electrostatic complementarities within the MBA-dMPP crystal. In addition, geometrical descriptors were also analyzed to the extent of surface interactions. MBA-dMPP was also investigated for in vitro antibacterial activity against Gram-positive and Gram-negative bacterial strains, and showed highest activity against Bacillus cereus (MIC = 12.5 μg mL-1) and Salmonella tythimurium (MIC = 50 μg mL-1). In silico screening was conducted by docking MBA-dMPP on the active site of S12 bacterial protein (an important therapeutic target of antibacterial agents) and its binding properties were compared with those of ciprofloxacin. Moreover, a field points map of MBA-dMPP ligand was studied to determine electrostatic and van der Waals forces, hydrophobic potentials

  11. Physicochemical analyses of a bioactive 4-aminoantipyrine analogue - synthesis, crystal structure, solid state interactions, antibacterial, conformational and docking studies.

    Science.gov (United States)

    Alam, Mohammad Sayed; Lee, Dong-Ung

    2016-01-01

    A novel Schiff base derivative of 4-aminoantipyrine, that is, (E)-4-(2-methoxybenzylideneamino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one (MBA-dMPP), was synthesized and characterized by FT-IR, (1)H-NMR, and EI-MS. Single-crystal X-ray diffraction data revealed MBA-dMPP adopts a trans configuration around its central C=N double bond, and forms orthorhombic crystals. XRD revealed that MBA-dMPP possess two different planes, in which the pyrazolone and benzylidene groups attached to C9 of the pyrazolone ring are almost coplanar and the phenyl ring connected to the N1 atom of the pyrazolone moiety lies in another plane. The intermolecular, host-guest C-H…O, C-H…N, and C-H…C van der Waals interactions were found to form a 3D network and confer stability to the MBA-dMPP crystal structure. The quantitative and qualitative solid state behaviors of MBA-dMPP were subjected to 3D Hirshfeld surface analysis and 2D fingerprint plotting. Reciprocal H…H contacts contributed most (52.9 %) to the Hirshfeld surface, followed by C…H/H…C contacts (30.2 %), whereas, O…H/H…O and N…H/H…N interactions contributed 15.5 % to the Hirshfeld surface. Electrostatic potentials were mapped over the Hirshfeld surface to analyze electrostatic complementarities within the MBA-dMPP crystal. In addition, geometrical descriptors were also analyzed to the extent of surface interactions. MBA-dMPP was also investigated for in vitro antibacterial activity against Gram-positive and Gram-negative bacterial strains, and showed highest activity against Bacillus cereus (MIC = 12.5 μg mL(-1)) and Salmonellatythimurium (MIC = 50 μg mL(-1)). In silico screening was conducted by docking MBA-dMPP on the active site of S12 bacterial protein (an important therapeutic target of antibacterial agents) and its binding properties were compared with those of ciprofloxacin. Moreover, a field points map of MBA-dMPP ligand was studied to determine electrostatic and van der Waals forces, hydrophobic

  12. Magnetic Resonance Studies of Proton Loss from Carotenoid Radical Cations

    Energy Technology Data Exchange (ETDEWEB)

    Kispert, Lowell D [Pacific Northwest National Lab. (PNNL), Richland, WA (United States); Focsan, A Ligia [Pacific Northwest National Lab. (PNNL), Richland, WA (United States); Konovalova, Tatyana A [Pacific Northwest National Lab. (PNNL), Richland, WA (United States); Lawrence, Jesse [Pacific Northwest National Lab. (PNNL), Richland, WA (United States); Bowman, Michael K [Pacific Northwest National Lab. (PNNL), Richland, WA (United States); Dixon, David A [Pacific Northwest National Lab. (PNNL), Richland, WA (United States); Molnar, Peter [Pacific Northwest National Lab. (PNNL), Richland, WA (United States); Deli, Jozsef [Pacific Northwest National Lab. (PNNL), Richland, WA (United States)

    2007-06-11

    Carotenoids, intrinsic components of reaction centers and pigment-protein complexes in photosynthetic membranes, play a photoprotective role and serve as a secondary electron donor. Before optimum use of carotenoids can be made in artificial photosynthetic systems, their robust nature in living materials requires extensive characterization of their electron transfer, radical trapping ability, stability, structure in and on various hosts, and photochemical behavior. Pulsed ENDOR and 2D-HYSCORE studies combined with DFT calculations reveal that photo-oxidation of natural zeaxanthin (I) and violaxanthin (II) on silica-alumina produces not only the carotenoid radical cations (Car•+) but also neutral radicals (#Car•) by proton loss from the methyl groups at positions 5 or 5', and possibly 9 or 9' and 13 or 13'. Notably, the proton loss favored in I at the 5 position by DFT calculations, is unfavorable in II due to the epoxide at the 5, 6 position. DFT calculations predict the isotropic methyl proton couplings of 8-10 MHz for Car•+ which agree with the ENDOR for carotenoid α-conjugated radical cations. Large α-proton hyperfine coupling constants (>10 MHz) determined from HYSCORE are assigned from the DFT calculations to neutral carotenoid radicals. Proton loss upon photolysis was also examined as a function of carotenoid polarity [Lycopene (III) versus 8'-apo-β-caroten-8'-al (IV)]; hydrogen bonding [Lutein (V) versus III]; host [silica-alumina versus MCM-41 molecular sieve]; and substituted metal in MCM-41. Loss of H+ from the 5(5'), 9(9') or 13(13') methyl positions has importance in photoprotection. Photoprotection involves nonphotochemical quenching (NPQ) in which 1Ch1* decays via energy transfer to the carotenoid which returns to the ground state by thermal dissipation; or via electron transfer to form a charge transfer state (I •+…Chl•-), lower in energy than 1Chl*. Formation of I •+ results in bond

  13. RPF151, a novel capsaicin-like analogue: in vitro studies and in vivo preclinical antitumor evaluation in a breast cancer model.

    Science.gov (United States)

    Ferreira, Adilson Kleber; Tavares, Maurício Temotheo; Pasqualoto, Kerly Fernanda Mesquita; de Azevedo, Ricardo Alexandre; Teixeira, Sarah Fernandes; Ferreira-Junior, Wilson Alves; Bertin, Ariane Matiello; de-Sá-Junior, Paulo Luiz; Barbuto, José Alexandre Marzagão; Figueiredo, Carlos Rogério; Cury, Yara; Damião, Mariana Celestina Frojuello Costa Bernstorff; Parise-Filho, Roberto

    2015-09-01

    Capsaicin, the primary pungent component of the chili pepper, has antitumor activity. Herein, we describe the activity of RPF151, an alkyl sulfonamide analogue of capsaicin, against MDA-MB-231 breast cancer cells. RPF151 was synthetized, and molecular modeling was used to compare capsaicin and RPF151. Cytotoxicity of RPF151 on MDA-MB-231 was also evaluated by the 3-[4,5-dimethylthiazol-2-yl]-2,5diphenyltetrazolium bromide (MTT) assay. Cell cycle analysis, by flow cytometry, and Western blot analysis of cycle-related proteins were used to evaluate the antiproliferative mechanisms. Apoptosis was evaluated by phosphatidyl-serine externalization, cleavage of Ac-YVAD-AMC, and Bcl-2 expression. The production of reactive oxygen species was evaluated by flow cytometry. RPF151 in vivo antitumor effects were investigated in murine MDA-MB-231 model. This study shows that RPF151 downregulated p21 and cyclins A, D1, and D3, leading to S-phase arrest and apoptosis. Although RPF151 has induced the activation of TRPV-1 and TRAIL-R1/DR4 and TRAIL-2/DR5 on the surface of MDA-MB-231 cells, its in vivo antitumor activity was TRPV-1-independent, thus suggesting that RPF151 should not have the same pungency-based limitation of capsaicin. In silico analysis corroborated the biological findings, showing that RPF151 has physicochemical improvements over capsaicin. Overall, the activity of RPF151 against MDA-MB-231 and its lower pungency suggest that it may have a relevant role in cancer therapy.

  14. Geomorphology and structural development of the nested summit crater of Láscar Volcano studied with Terrestrial Laser Scanner data and analogue modelling

    Science.gov (United States)

    de Zeeuw-van Dalfsen, Elske; Richter, Nicole; González, Gabriel; Walter, Thomas R.

    2017-01-01

    Many volcano summits host craters that are partially overlapping. The formation of such nested craters has been commonly interpreted as vent migration. Here, we present an additional mechanism that may explain the geometry of nested craters at volcanoes. Láscar Volcano, the most active volcano of the Central Volcanic Zone in the Chilean Andes, hosts ENE-WSW trending summit craters that are partially overlapping (nested). Details on the evolution and interaction between the different craters remain unclear. To create a robust dataset, Terrestrial Laser Scanner (TLS) data were collected at the summit of Láscar in 2013. The resulting topographic data set, consisting of more than 15 million data points with centimetre sampling, allows visualising almost the complete eastern edifice of the volcano's summit. From the TLS data, a Digital Elevation Model (DEM) and a slope map were generated allowing us to create a lineament map and quantify the observed morphological and structural features. To further improve our understanding of the processes responsible for the formation of the craters and geomorphology, we designed sandbox analogue models. Results suggest that one of the craters is a 'parasite' crater, formed as a consequence of ongoing activity in the adjacent crater. Our data suggest that the nested craters have all been modified since the last major eruption in 1993, by near surface effects associated with cooling, compaction and gravitational sliding of the crater floor infill. As the active crater deepens, the adjacent inactive crater extends and partially slumps towards the active one. Understanding the structural development of these nested craters is relevant for assessing potential future eruption sites, thus making Láscar a dynamic target for a detailed morphology study. These findings may similarly be applied to other volcanoes, where nested craters have developed.

  15. Comparative study of spectroscopic properties of the low-lying electronic states of 2,4-pentadien-1-iminium cation and its N-substituted analogues

    Indian Academy of Sciences (India)

    Anjan Chattopadhyay

    2012-09-01

    Semiempirical and ab initio-based CI methods have been employed to study the low-lying electronic states of 2,4-pentadien-1-iminium cation and its N-substituted analogues with electron-donating (methyl, isopropyl) and electron-withdrawing (fluoromethyl) groups on nitrogen. Variations of the dihedral angles (Γ3, Γ4) of the ground state have given the global minima and global maxima at (180°, 180°) and (90°, 0°) conformations, respectively, with some exceptions in the case of fluoromethyl compound. Increase in the +I effect on nitrogen shifts the TICT conical intersection point away from the 90° (Γ3 dihedral angle) value, when the Γ4 value is kept fixed at 180°. Transition moment values of the allowed S0(1A -like) → S1 (2B-like) transitions are expectedly higher than the forbidden S0(1A -like) → S2(2A -like) transitions by almost 5.6 D. Radiative lifetime values of the first excited states are calculated to be around 215 ps for all the four compounds. At (180°, 180°) conformation the vertical excitation energy (VEE) between the S0 and S1 states of the 2,4-pentadieniminium cation is found to be 3.3 eV, which corresponds to the absorption wavelength value of roughly 375 nm. The VEE value increases with substituents having +I effect on nitrogen, while for the fluoromethyl compound it is calculated to be around 2.85 eV. The energy gap between the first two excited singlet states is found to have the least value in the isopropyl-substituted compound, where the S2 state contains a huge contribution from the HOMO2→LUMO2 configuration.

  16. Influence of the Charge State on the Structures and Interactions of Vancomycin Antibiotics with Cell-Wall Analogue Peptides: Experimental and Theoretical Studies

    Energy Technology Data Exchange (ETDEWEB)

    Yang, Zhibo; Vorpagel, Erich R.; Laskin, Julia

    2009-02-16

    In this study we examined the effect of the charge state on the energetics and dynamics of dissociation of the non-covalent complex between the vancomycin and the cell wall peptide analogue Nα,Nε-diacetyl-L-Lys-D-Ala-D-Ala (V-Ac2KDADA). The binding energies between the vancomycin and the peptide were obtained from the RRKM modeling of the time- and energy resolved surface-induced dissociation (SID) experiments. Our results demonstrate that the stability of the complex toward fragmentation increases in the order: [V+Ac2KDADA+H]+2 < [V+Ac2KDADA+H]+ < [V+Ac2KDADA-H]-. Dissociation of the singly protonated and singly deprotonated complex is characterized by very large entropy effects indicating substantial increase in the conformational flexibility of the resulting products. The experimental threshold energies of 1.75 eV and 1.34 eV obtained for the [V+Ac2KDADA-H]- and [V+Ac2KDADA+H]+ , respectively, are in excellent agreement with the results of density functional theory (DFT) calculations. The increased stability of the deprotonated complex observed experimentally is attributed to the presence of three charged sites in the deprotonated complex as compared to only one charged site in the singly protonated complex. The low binding energy of 0.93 eV obtained for the doubly protonated complex suggests that this ion is destabilized by Coulomb repulsion between the singly protonated vancomycin and the singly protonated peptide comprising the complex.

  17. Inner hydrogen atom transfer in benzo-fused low symmetrical metal-free tetraazaporphyrin and phthalocyanine analogues: density functional theory studies.

    Science.gov (United States)

    Qi, Dongdong; Zhang, Yuexing; Cai, Xue; Jiang, Jianzhuang; Bai, Ming

    2009-02-01

    Density functional theory (DFT) calculations were carried out to study the inner hydrogen atom transfer in low symmetrical metal-free tetrapyrrole analogues ranging from tetraazaporphyrin H(2)TAP (A(0)B(0)C(0)D(0)) to naphthalocyanine H(2)Nc (A(2)B(2)C(2)D(2)) via phthalocyanine H(2)Pc (A(1)B(1)C(1)D(1)). All the transition paths of sixteen different compounds (A(0)B(0)C(0)D(0)-A(2)B(2)C(2)D(2) and A(0)B(0)C(m)D(n), m rings onto the TAP skeleton have significant effect on the potential energy barrier of the inner hydrogen atom transfer. Introducing fused benzene rings onto the hydrogen-releasing pyrrole rings can increase the transitivity of inner hydrogen atom and thus lower the transfer barrier of this inner hydrogen atom while fusing benzene rings onto the hydrogen-accepting pyrrole rings will increase the hydrogen transfer barrier to this pyrrole ring. The transient cis-isomer intermediate with hydrogen atoms joined to the two adjacent pyrrole rings with less fused benzene rings is much stable than the others. It is also found that the benzene rings fused directly onto pyrrole rings have more effect on the inner hydrogen atom transfer than the outer benzene rings fused onto the periphery of isoindole rings. The present work, representing the first effort towards systematically understanding the effect of ring enlargement through asymmetrical peripheral fusion of benzene ring(s) onto the TAP skeleton on the inner hydrogen transfer of tetrapyrrole derivatives, will be helpful in clarifying the N-H tautomerization phenomenon and detecting the cis-porphyrin isomer in bio-systems.

  18. Analysis and experimental study on the effect of a resonant tube on the performance of acoustic levitation devices

    Science.gov (United States)

    Jiang, Hai; Liu, Jianfang; Lv, Qingqing; Gu, Shoudong; Jiao, Xiaoyang; Li, Minjiao; Zhang, Shasha

    2016-09-01

    The influence of a resonant tube on the performance of acoustic standing wave-based levitation device (acoustic levitation device hereinafter) is studied by analyzing the acoustic pressure and levitation force of four types of acoustic levitation devices without a resonance tube and with resonance tubes of different radii R using ANSYS and MATLAB. Introducing a resonance tube either enhances or weakens the levitation strength of acoustic levitation device, depending on the resonance tube radii. Specifically, the levitation force is improved to a maximum degree when the resonance tube radius is slightly larger than the size of the reflector end face. Furthermore, the stability of acoustic levitation device is improved to a maximum degree by introducing a resonance tube of R=1.023λ. The experimental platform and levitation force measurement system of the acoustic levitation device with concave-end-face-type emitter and reflector are developed, and the test of suspended matters and liquid drops is conducted. Results show that the Φ6.5-mm steel ball is suspended easily when the resonance tube radius is 1.023λ, and the Φ5.5-mm steel ball cannot be suspended when the resonance tube radius is 1.251λ. The levitation capability of the original acoustic levitation device without a resonance tube is weakened when a resonance tube of R=1.251λ is applied. These results are consistent with the ANSYS simulation results. The levitation time of the liquid droplet with a resonance tube of R=1.023λ is longer than without a resonance tube. This result is also supported by the MATLAB simulation results. Therefore, the performance of acoustic levitation device can be improved by introducing a resonant tube with an appropriate radius.

  19. Resonance of graphene nanoribbons doped with nitrogen and boron: a molecular dynamics study

    Directory of Open Access Journals (Sweden)

    Ye Wei

    2014-05-01

    Full Text Available Based on its enticing properties, graphene has been envisioned with applications in the area of electronics, photonics, sensors, bio-applications and others. To facilitate various applications, doping has been frequently used to manipulate the properties of graphene. Despite a number of studies conducted on doped graphene regarding its electrical and chemical properties, the impact of doping on the mechanical properties of graphene has been rarely discussed. A systematic study of the vibrational properties of graphene doped with nitrogen and boron is performed by means of a molecular dynamics simulation. The influence from different density or species of dopants has been assessed. It is found that the impacts on the quality factor, Q, resulting from different densities of dopants vary greatly, while the influence on the resonance frequency is insignificant. The reduction of the resonance frequency caused by doping with boron only is larger than the reduction caused by doping with both boron and nitrogen. This study gives a fundamental understanding of the resonance of graphene with different dopants, which may benefit their application as resonators.

  20. A study on species transport in the corrosion products of ferrous archaeological analogues - a contribution to the modelling of iron long term corrosion behaviour

    Energy Technology Data Exchange (ETDEWEB)

    Vega, E.; Dillmann, Ph.; Fluzin, Ph. [LRC CEA DSM 01-27: IRAMAT UMR5060 CNRS et Laboratoire Pierre Sue (CEA/CNRS), CEA Saclay 91191 Gif-sur-Yvette Cedex (France)

    2004-07-01

    One of the main technological and environmental challenges for the next centuries is the safe storage of nuclear wastes. For this purpose, the behaviour during several centuries of every material constituting the barrier between wastes and environment must be predicted. In addition to modelling and laboratory simulations, the only mean to study corrosion systems formed during several centuries is to analyse archaeological ferrous artefacts buried in soil. Precedent studies on this kind of artefacts have shown that the corrosion system is formed by the metallic core, a dense corrosion product layer, a transformed medium constituted of a mix of corrosion products and soil compounds, and the soil itself. Moreover, analytical and electrochemical studies seem to show that the corrosion mechanisms are driven by the species transport in the dense product layer (DPL) and especially by oxygen migration in the DPL pores. Thus, it seems necessary to precise the species transport properties in the DPL. A characterisation study on ferrous artefacts coming from the site of Glinet (16. AD) have been carried out. The rust layers have been studied using several techniques. The composition analyses were performed with Energy Dispersive Spectroscopy (EDS) coupled to the Scanning Electron Microscope, and Electron Probe Microanalysis (EPMA). Structural information have been obtained by X-ray micro-diffraction ({mu}XRD) and micro-Raman spectroscopy. The aim of this communication is to present the results of a study performed with markers in order to better understand the species transport in the DPL. Experiments focus on an archaeological artefact part from Glinet excavation. The migration in the DPL of I and Na ions (which have roughly the same diffusion coefficient in water than oxygen) will be studied by immersion of an archaeological analogue with his DPL in a saturated iodide (NaI) aqueous solution. After different immersion times (1 h, 3 h, 7 h and 168 h), the concentration

  1. Biochemical Support for the “Threshold” Theory of Creativity: A Magnetic Resonance Spectroscopy Study

    OpenAIRE

    2009-01-01

    A broadly accepted definition of creativity refers to the production of something both novel and useful within a given social context. Studies of patients with neurological and psychiatric disorders and neuroimaging studies of healthy controls have each drawn attention to frontal and temporal lobe contributions to creativity. Based on previous magnetic resonance (MR) spectroscopy studies demonstrating relationships between cognitive ability and concentrations of N-acetyl-aspartate (NAA), a co...

  2. Thermally stimulated luminescence and electron paramagnetic resonance studies on uranium doped calcium phosphate

    CERN Document Server

    Natarajan, V; Veeraraghavan, R; Sastry, M D

    2003-01-01

    Thermally stimulated luminescence (TSL) and electron paramagnetic resonance (EPR) studies on uranium doped calcium phosphate yielded mechanistic information on the observed glow peaks at 365, 410 and 450 K. TSL spectral studies of the glow peaks showed that UO sub 2 sup 2 sup + acts as the luminescent center. Electron paramagnetic resonance studies on gamma-irradiated samples revealed that the predominant radiation induced centers are H sup 0 , PO sub 4 sup 2 sup - , PO sub 3 sup 2 sup - and O sup - ion. Studies on the temperature dependence studies of the EPR spectra of samples annealed to different temperatures indicate the role of H sup 0 and PO sub 4 sup 2 sup - ions in the main glow peak at 410 K.

  3. Optically Detected Magnetic Resonance Studies on π-conjugated semiconductor systems

    Energy Technology Data Exchange (ETDEWEB)

    Chen, Ying [Iowa State Univ., Ames, IA (United States)

    2011-01-01

    Optically Detected Magnetic Resonance (ODMR) techniques were used to investigate the dynamics of excitons and charge carriers in π-conjugated organic semiconductors. Degradation behavior of the negative spin-1/2 electroluminescence-detected magnetic resonance (ELDMR) was observed in Alq3 devices. The increase in the resonance amplitude implies an increasing bipolaron formation during degradation, which might be the result of growth of charge traps in the device. The same behavior of the negative spin-1/2 ELDMR was observed in 2wt% Rubrene doped Tris(8-hydroxyquinolinato)aluminium (Alq3) devices. However, with increasing injection current, a positive spin-1/2 ELDMR, together with positive spin 1 triplet powder patterns at ΔmS=±1 and ΔmS=±2, emerges. Due to the similarities in the frequency dependences of single and double modulated ELDMR and the photoluminescence-detected magnetic resonance (PLDMR) results in poly[2-methoxy-5-(2 -ethyl-hexyloxy)-1,4-phenyl ene vinylene] (MEH-PPV) films, the mechanism for this positive spin-1/2 ELDMR was assigned to enhanced triplet-polaron quenching under resonance conditions. The ELDMR in rubrene doped Alq3 devices provides a path to investigate charge distribution in the device under operational conditions. Combining the results of several devices with different carrier blocking properties and the results from transient EL, it was concluded trions not only exist near buffer layer but also exist in the electron transport layer. This TPQ model can also be used to explain the positive spin-1/2 PLDMR in poly(3-hexylthiophene) (P3HT) films at low temperature and in MEH-PPV films at various temperatures up to room temperature. Through quantitative analysis, TE-polaron quenching (TPQ) model is shown having the ability to explain most behaviors of the positive spin-1/2 resonance. Photocurrent detected magnetic resonance (PCDMR) studies on MEH-PPV devices revealed a novel transient resonance signal. The signal

  4. Electron Spin Resonance and optical absorption spectroscopic studies of manganese centers in aluminium lead borate glasses

    Science.gov (United States)

    SivaRamaiah, G.; LakshmanaRao, J.

    2012-12-01

    Electron Spin Resonance (ESR) and optical absorption studies of 5Al2O3 + 75H3BO3 + (20-x)PbO + xMnSO4 (where x = 0.5, 1,1.5 and 2 mol% of MnSO4) glasses at room temperature have been studied. The ESR spectrum of all the glasses exhibits resonance signals with effective isotropic g values at ≈2.0, 3.3 and 4.3. The ESR resonance signal at isotropic g ≈ 2.0 has been attributed to Mn2+ centers in an octahedral symmetry. The ESR resonance signals at isotropic g ≈ 3.3 and 4.3 have been attributed to the rhombic symmetry of the Mn2+ ions. The zero-field splitting parameter (zfs) has been calculated from the intensities of the allowed hyperfine lines. The optical absorption spectrum exhibits an intense band in the visible region and it has been attributed to 5Eg → 5T2g transition of Mn3+centers in an octahedral environment. The optical band gap and the Urbach energies have been calculated from the ultraviolet absorption edges.

  5. Post-operative Pain Analysis between Single Visit and Two Visit Root Canal Treatments using Visual Analogue Scale: An In Vivo Study

    Directory of Open Access Journals (Sweden)

    Kavita Tarale

    2013-01-01

    Full Text Available The purpose of this clinical study was to evaluate post-operative pain, after root canal therapy, performed in one appointment versus two appointment using calcium hydroxide intracanal medicament. Study design: In this in-vivo study, 60 patients requiring root canal therapy on permanent 1st molars were included. Patients were randomly divided into two experimental and one control group. Group1: One visit therapy (n=20 Group2: Two visit therapy with 1 week of calcium hydroxide dressing (n=20 Group3(Control: Two visit therapy with 1 week of sterile dry cotton pellet dressing (n=20 Materials and method : The standard protocol for all the patients included local anaesthesia, isolation & access cavity preparation, chemomechanical preparation with Rotary Protaper NiTi instruments, and irrigation with 3% sodium hypochlorite, 17% EDTA, 0.9%saline and 2% chlorhexidine. Teeth in group1 (n=20 were obturated on the same appointment using single cone technique (6% gutta percha points and AH Plus sealer. Teeth in group 2(n=20 and group 3(n=20 were given a dressing of calcium hydroxide and dry cotton pellet respectively for a week followed by double seal with Cavit G and IRM. These teeth were obturated on the 2nd appointment using same material and techniques as in group 1. Teeth in all three groups were restored with dual cure composite resin. A modified Visual Analogue Scale was used to measure preoperative pain and postoperative pain after 6, 12, 24 & 48hrs interval. Statistical analysis was performed using an independent-sample t test. There was no statistically significant difference between groups at any of the four postoperative intervals. There was no significant difference among all the three groups studied after 12, 24hrs & 48hrs. Conclusion : Within the limitations of this in vivo study, it may be concluded that Single Visit Endodontics provides excellent results, if care in diagnosis and proper case selection is given importance. Calcium hydroxide

  6. QM/MM Studies of the Matrix Metalloproteinase 2 (MMP2) Inhibition Mechanism of (S)-SB-3CT and its Oxirane Analogue.

    Science.gov (United States)

    Zhou, Jia; Tao, Peng; Fisher, Jed F; Shi, Qicun; Mobashery, Shahriar; Schlegel, H Bernhard

    2010-11-09

    SB-3CT, (4-phenoxyphenylsulfonyl)methylthiirane, is a potent, mechanism-based inhibitor of the gelatinase sub-class of the matrix metalloproteinase (MMP) family of zinc proteases. The gelatinase MMPs are unusual in that there are several examples where both enantiomers of a racemic inhibitor have comparable inhibitory abilities. SB-3CT is one such example. Here, the inhibition mechanism of the MMP2 gelatinase by the (S)-SB-3CT enantiomer and its oxirane analogue is examined computationally, and compared to the mechanism of (R)-SB-3CT. Inhibition of MMP2 by (R)-SB-3CT was shown previously to involve enzyme-catalyzed C-H deprotonation adjacent to the sulfone, with concomitant opening by β-elimination of the sulfur of the three-membered thiirane ring. Similarly to the R enantiomer, (S)-SB-3CT was docked into the active site of MMP2, followed by molecular dynamics simulation to prepare the complex for combined quantum mechanics and molecular mechanics (QM/MM) calculations. QM/MM calculations with B3LYP/6-311+G(d,p) for the QM part (46 atoms) and the AMBER force field for the MM part were used to compare the reaction of (S)-SB-3CT and its oxirane analogue in the active site of MMP2 (9208 atoms). These calculations show that the barrier for the proton abstraction coupled ring opening reaction of (S)-SB-3CT in the MMP2 active site is 4.4 kcal/mol lower than its oxirane analogue, and the ring opening reaction energy of (S)-SB-3CT is only 1.6 kcal/mol less exothermic than its oxirane analogue. Calculations also show that the protonation of the ring-opened products by water is thermodynamically much more favorable for the alkoxide obtained from the oxirane, than for the thiolate obtained from the thiirane. In contrast to (R)-SB-3CT and the R-oxirane analogue, the double bonds of the ring-opened products of (S)-SB-3CT and its S-oxirane analogue have the cis-configuration. Vibrational frequency and intrinsic reaction path calculations on a reduced size QM/MM model (2747 atoms

  7. Real time hybridization studies by resonant waveguide gratings using nanopattern imaging for Single Nucleotide Polymorphism detection

    KAUST Repository

    Bougot-Robin, Kristelle

    2013-12-20

    2D imaging of biochips is particularly interesting for multiplex biosensing. Resonant properties allow label-free detection using the change of refractive index at the chip surface. We demonstrate a new principle of Scanning Of Resonance on Chip by Imaging (SORCI) based on spatial profiles of nanopatterns of resonant waveguide gratings (RWGs) and its embodiment in a fluidic chip for real-time biological studies. This scheme allows multiplexing of the resonance itself by providing nanopattern sensing areas in a bioarray format. Through several chip designs we discuss resonance spatial profiles, dispersion and electric field distribution for optimal light-matter interaction with biological species of different sizes. Fluidic integration is carried out with a black anodized aluminum chamber, advantageous in term of mechanical stability, multiple uses of the chip, temperature control and low optical background. Real-time hybridization experiments are illustrated by SNP (Single Nucleotide Polymorphism) detection in gyrase A of E. coli K12, observed in evolution studies of resistance to the antibiotic ciprofloxacin. We choose a 100 base pairs (bp) DNA target (∼30 kDa) including the codon of interest and demonstrate the high specificity of our technique for probes and targets with close affinity constants. This work validates the safe applicability of our unique combination of RWGs and simple instrumentation for real-time biosensing with sensitivity in buffer solution of ∼10 pg/mm2. Paralleling the success of RWGs sensing for cells sensing, our work opens new avenues for a large number of biological studies. © 2013 Springer Science+Business Media.

  8. Study of hyperon-pion resonances from kaonic absorption with KLOE

    Directory of Open Access Journals (Sweden)

    Vázquez Doce Oton

    2015-01-01

    The study of the antiK-hadron interactions inside the drift chamber of KLOE was initiated in order to search for signals from the formation of deeply bound kaonic nuclear states and the study of resonances like the Λ(1405 and the Σ(1385, and constitute a first step towards the preparation of the AMADEUS experiment at DAFNE, the e+e− collider of the Frascati National Laboratories (Italy of INFN.

  9. A study of two-level system defects in dielectric films using superconducting resonators

    Science.gov (United States)

    Khalil, Moe Shwan

    In this dissertation I describe measurements of dielectric loss at microwave frequencies due to two level systems (TLS) using superconducting resonators. Most measurements were performed in a dilution refrigerator at temperatures between 30 and 200 mK and all resonators discussed were fabricated with thin-film superconducting aluminum. I derive the transmission through a non-ideal (mismatched) resonant circuit and find that in general the resonance line-shape is asymmetric. I describe an analysis method for extracting the internal quality factor (Q i), the diameter correction method (DCM), and compare it to a commonly used phenomenological method, the phi rotation method (phiRM). I analytically find that the phiRM deterministically overestimates Qi when the asymmetry of the resonance line-shape is high. Four coplanar resonator geometries were studied, with frequencies spanning 5-7 GHz. They were all superconducting aluminum fabricated on sapphire and silicon substrates. These include a quasi-lumped element resonator, a coplanar strip transmission line resonator, and two hybrid designs that contain both a coplanar strip and a quasi-lumped element. Measured Qi's were as high as 2 x 105 for single photon excitations and there was no systematic variation in loss between quasi-lumped and coplanar strip resonance modes. I also measured the microwave loss tangent of several atomic layer deposition (ALD) grown dielectrics and obtained secondary ion mass spectrometry (SIMS) measurements of the same films. I found that hydrogen defect concentrations were correlated with low temperature microwave loss. In amorphous films that showed excess hydrogen defects on the surface, two independent TLS distributions were required to fit the loss tangent, one for the surface and one for the bulk. In crystalline dielectrics where hydrogen contamination was uniform throughout the bulk, a single bulk TLS distribution was sufficient. Finally, I measured the TLS loss in 250 nm thick HD

  10. Study of orbitally excited B mesons and evidence for a new Bπ resonance

    Science.gov (United States)

    Aaltonen, T.; Amerio, S.; Amidei, D.; Anastassov, A.; Annovi, A.; Antos, J.; Apollinari, G.; Appel, J. A.; Arisawa, T.; Artikov, A.; Asaadi, J.; Ashmanskas, W.; Auerbach, B.; Aurisano, A.; Azfar, F.; Badgett, W.; Bae, T.; Barbaro-Galtieri, A.; Barnes, V. E.; Barnett, B. A.; Barria, P.; Bartos, P.; Bauce, M.; Bedeschi, F.; Behari, S.; Bellettini, G.; Bellinger, J.; Benjamin, D.; Beretvas, A.; Bhatti, A.; Bland, K. R.; Blumenfeld, B.; Bocci, A.; Bodek, A.; Bortoletto, D.; Boudreau, J.; Boveia, A.; Brigliadori, L.; Bromberg, C.; Brucken, E.; Budagov, J.; Budd, H. S.; Burkett, K.; Busetto, G.; Bussey, P.; Butti, P.; Buzatu, A.; Calamba, A.; Camarda, S.; Campanelli, M.; Canelli, F.; Carls, B.; Carlsmith, D.; Carosi, R.; Carrillo, S.; Casal, B.; Casarsa, M.; Castro, A.; Catastini, P.; Cauz, D.; Cavaliere, V.; Cavalli-Sforza, M.; Cerri, A.; Cerrito, L.; Chen, Y. C.; Chertok, M.; Chiarelli, G.; Chlachidze, G.; Cho, K.; Chokheli, D.; Clark, A.; Clarke, C.; Convery, M. E.; Conway, J.; Corbo, M.; Cordelli, M.; Cox, C. A.; Cox, D. J.; Cremonesi, M.; Cruz, D.; Cuevas, J.; Culbertson, R.; d'Ascenzo, N.; Datta, M.; de Barbaro, P.; Demortier, L.; Deninno, M.; Devoto, F.; D'Errico, M.; Di Canto, A.; Di Ruzza, B.; Dittmann, J. R.; D'Onofrio, M.; Donati, S.; Dorigo, M.; Driutti, A.; Ebina, K.; Edgar, R.; Elagin, A.; Erbacher, R.; Errede, S.; Esham, B.; Farrington, S.; Feindt, M.; Fernández Ramos, J. P.; Field, R.; Flanagan, G.; Forrest, R.; Franklin, M.; Freeman, J. C.; Frisch, H.; Funakoshi, Y.; Galloni, C.; Garfinkel, A. F.; Garosi, P.; Gerberich, H.; Gerchtein, E.; Giagu, S.; Giakoumopoulou, V.; Gibson, K.; Ginsburg, C. M.; Giokaris, N.; Giromini, P.; Giurgiu, G.; Glagolev, V.; Glenzinski, D.; Gold, M.; Goldin, D.; Golossanov, A.; Gomez, G.; Gomez-Ceballos, G.; Goncharov, M.; González López, O.; Gorelov, I.; Goshaw, A. T.; Goulianos, K.; Gramellini, E.; Grinstein, S.; Grosso-Pilcher, C.; Group, R. C.; Guimaraes da Costa, J.; Hahn, S. R.; Han, J. Y.; Happacher, F.; Hara, K.; Hare, M.; Harr, R. F.; Harrington-Taber, T.; Hatakeyama, K.; Hays, C.; Heck, M.; Heinrich, J.; Herndon, M.; Hocker, A.; Hong, Z.; Hopkins, W.; Hou, S.; Hughes, R. E.; Husemann, U.; Hussein, M.; Huston, J.; Introzzi, G.; Iori, M.; Ivanov, A.; James, E.; Jang, D.; Jayatilaka, B.; Jeon, E. J.; Jindariani, S.; Jones, M.; Joo, K. K.; Jun, S. Y.; Junk, T. R.; Kambeitz, M.; Kamon, T.; Karchin, P. E.; Kasmi, A.; Kato, Y.; Ketchum, W.; Keung, J.; Kilminster, B.; Kim, D. H.; Kim, H. S.; Kim, J. E.; Kim, M. J.; Kim, S. B.; Kim, S. H.; Kim, Y. K.; Kim, Y. J.; Kimura, N.; Kirby, M.; Knoepfel, K.; Kondo, K.; Kong, D. J.; Konigsberg, J.; Kotwal, A. V.; Kreps, M.; Kroll, J.; Kruse, M.; Kuhr, T.; Kurata, M.; Laasanen, A. T.; Lammel, S.; Lancaster, M.; Lannon, K.; Latino, G.; Lee, H. S.; Lee, J. S.; Leo, S.; Leone, S.; Lewis, J. D.; Limosani, A.; Lipeles, E.; Lister, A.; Liu, H.; Liu, Q.; Liu, T.; Lockwitz, S.; Loginov, A.; Lucà, A.; Lucchesi, D.; Lueck, J.; Lujan, P.; Lukens, P.; Lungu, G.; Lys, J.; Lysak, R.; Madrak, R.; Maestro, P.; Malik, S.; Manca, G.; Manousakis-Katsikakis, A.; Marchese, L.; Margaroli, F.; Marino, P.; Martínez, M.; Matera, K.; Mattson, M. E.; Mazzacane, A.; Mazzanti, P.; McNulty, R.; Mehta, A.; Mehtala, P.; Mesropian, C.; Miao, T.; Mietlicki, D.; Mitra, A.; Miyake, H.; Moed, S.; Moggi, N.; Moon, C. S.; Moore, R.; Morello, M. J.; Mukherjee, A.; Muller, Th.; Murat, P.; Mussini, M.; Nachtman, J.; Nagai, Y.; Naganoma, J.; Nakano, I.; Napier, A.; Nett, J.; Neu, C.; Nigmanov, T.; Nodulman, L.; Noh, S. Y.; Norniella, O.; Oakes, L.; Oh, S. H.; Oh, Y. D.; Oksuzian, I.; Okusawa, T.; Orava, R.; Ortolan, L.; Pagliarone, C.; Palencia, E.; Palni, P.; Papadimitriou, V.; Parker, W.; Pauletta, G.; Paulini, M.; Paus, C.; Phillips, T. J.; Piacentino, G.; Pianori, E.; Pilot, J.; Pitts, K.; Plager, C.; Pondrom, L.; Poprocki, S.; Potamianos, K.; Prokoshin, F.; Pranko, A.; Ptohos, F.; Punzi, G.; Ranjan, N.; Redondo Fernández, I.; Renton, P.; Rescigno, M.; Rimondi, F.; Ristori, L.; Robson, A.; Rodriguez, T.; Rolli, S.; Ronzani, M.; Roser, R.; Rosner, J. L.; Ruffini, F.; Ruiz, A.; Russ, J.; Rusu, V.; Sakumoto, W. K.; Sakurai, Y.; Santi, L.; Sato, K.; Saveliev, V.; Savoy-Navarro, A.; Schlabach, P.; Schmidt, E. E.; Schwarz, T.; Scodellaro, L.; Scuri, F.; Seidel, S.; Seiya, Y.; Semenov, A.; Sforza, F.; Shalhout, S. Z.; Shears, T.; Shepard, P. F.; Shimojima, M.; Shochet, M.; Shreyber-Tecker, I.; Simonenko, A.; Sliwa, K.; Smith, J. R.; Snider, F. D.; Sorin, V.; Song, H.; Stancari, M.; St. Denis, R.; Stentz, D.; Strologas, J.; Sudo, Y.; Sukhanov, A.; Suslov, I.; Takemasa, K.; Takeuchi, Y.; Tang, J.; Tecchio, M.; Teng, P. K.; Thom, J.; Thomson, E.; Thukral, V.; Toback, D.; Tokar, S.; Tollefson, K.; Tomura, T.; Tonelli, D.; Torre, S.; Torretta, D.; Totaro, P.; Trovato, M.; Ukegawa, F.; Uozumi, S.; Vázquez, F.; Velev, G.; Vellidis, C.; Vernieri, C.; Vidal, M.; Vilar, R.; Vizán, J.; Vogel, M.; Volpi, G.; Wagner, P.; Wallny, R.; Wang, S. M.; Waters, D.; Wester, W. C.; Whiteson, D.; Wicklund, A. B.; Wilbur, S.; Williams, H. H.; Wilson, J. S.; Wilson, P.; Winer, B. L.; Wittich, P.; Wolbers, S.; Wolfe, H.; Wright, T.; Wu, X.; Wu, Z.; Yamamoto, K.; Yamato, D.; Yang, T.; Yang, U. K.; Yang, Y. C.; Yao, W.-M.; Yeh, G. P.; Yi, K.; Yoh, J.; Yorita, K.; Yoshida, T.; Yu, G. B.; Yu, I.; Zanetti, A. M.; Zeng, Y.; Zhou, C.; Zucchelli, S.; CDF Collaboration

    2014-07-01

    Using the full CDF Run II data sample, we report evidence for a new resonance, which we refer to as B(5970), found simultaneously in the B0π+ and B+π- mass distributions with a significance of 4.4 standard deviations. We further report the first study of resonances consistent with orbitally excited B+ mesons and an updated measurement of the properties of orbitally excited B0 and Bs0 mesons. We measure the masses and widths of all states, as well as the relative production rates of the B1, B2*, and B(5970) states and the branching fraction of the Bs2*0 state to either B*+K- and B+K-. Furthermore, we measure the production rates of the orbitally excited B0,+ states relative to the B0,+ ground state. The masses of the new B(5970) resonances are 5978±5(stat)±12(syst) MeV/c2 for the neutral state and 5961±5(stat)±12(syst) MeV /c2 for the charged state, assuming that the resonance decays into Bπ final states. The properties of the orbitally excited and the new B(59700,+) states are compatible with isospin symmetry.

  11. Contribution to the study of the resonant rotation in the Solar System

    CERN Document Server

    Noyelles, Benoît

    2015-01-01

    This HDR-thesis is devoted to the study of the rotation of the natural satellites of the giant planets and of Mercury. These bodies have a resonant rotation. Most of the natural satellites rotate synchronously, showing the same hemisphere to their parent planet (1:1 spin-orbit resonance). The case of Mercury is unique since its spin rate is exactly 1.5 its mean motion (3:2 spin-orbit resonance). These two configurations are dynamical equilibria, reached after damping of the initial rotation of the relevant bodies. Thus, the rotation quantities are a signature of the interior, in particular of a putative global ocean. This manuscript divides into 3 parts. The first part is devoted to the synchronous resonance. It presents different models of rotation from a fully rigid body to a one with a global subsurfacic ocean. We always consider all the degrees of freedom simultaneously, using analytical and numerical resolutions. These models are applied on Titan, Callisto, Janus, Epimetheus, Mimas, Hyperion, and Io. The...

  12. A comparative study of piezoelectric unimorph and multilayer actuators as stiffness sensors via contact resonance

    Institute of Scientific and Technical Information of China (English)

    Ji Fu; Fa-Xin Li

    2016-01-01

    Piezoelectric bar-shaped resonators were pro-posed to act as hardness sensors in the 1960s and stiffness sensors in the 1990s based on the contact impedance method. In this work, we point out that both multilayer and uni-morph (or bimorph) piezoelectric actuators could act as stiffness/modulus sensors based on the principle of mechan-ical contact resonance. First, the practical design and the performance of a piezoelectric unimorph actuator–based stiffness sensor were presented. Then the working principle of piezoelectric multilayer actuator–based stiffness sensors was given and verified by numerical investigation. It was found that for these two types of resonance-based sen-sors, the shift of the resonance frequency due to contact is always positive, which is different from that of the contact impedance method. Further comparative sensitivity study indicated that the unimorph actuator–based stiffness sensor is very suitable for measurement on soft materials, whereas the multilayer actuator–based sensor is more suitable for hard materials.

  13. A comparative study of piezoelectric unimorph and multilayer actuators as stiffness sensors via contact resonance

    Science.gov (United States)

    Fu, Ji; Li, Fa-Xin

    2016-08-01

    Piezoelectric bar-shaped resonators were proposed to act as hardness sensors in the 1960s and stiffness sensors in the 1990s based on the contact impedance method. In this work, we point out that both multilayer and unimorph (or bimorph) piezoelectric actuators could act as stiffness/modulus sensors based on the principle of mechanical contact resonance. First, the practical design and the performance of a piezoelectric unimorph actuator-based stiffness sensor were presented. Then the working principle of piezoelectric multilayer actuator-based stiffness sensors was given and verified by numerical investigation. It was found that for these two types of resonance-based sensors, the shift of the resonance frequency due to contact is always positive, which is different from that of the contact impedance method. Further comparative sensitivity study indicated that the unimorph actuator-based stiffness sensor is very suitable for measurement on soft materials, whereas the multilayer actuator-based sensor is more suitable for hard materials.

  14. A study on the microwave responses of YBCO and TBCCO thin films by coplanar resonator technique

    Institute of Scientific and Technical Information of China (English)

    2007-01-01

    YBa2CuaO7(YBCO) thin films have been prepped by thermal coevaporation on LaAlO3 (LAO) substrates, and Tl2Ba2CaCu2O8(TBCCO) thin films are synthesized by magnetron sputtering method on LAO substrates. The transition temperature Tc is 90 K for YBCO/LAO and 104K for TBCCO/LAO. Microwave responses of the films are studied systematically by coplanar resonator technique. Energu gaps of the films obtained are △0 = 1.04kBTc for YBCO films and △0 = 0.84kBTc for TBCCO films by analysing the temperature dependence of resonant frequencies of coplanar resonator. Penetration depth at 0K λ0 = 198 nm for YBCO films and λ0 = 200 nm for TBCCO films could also be obtained by using the weak coupling theory and two fluid theory. Results of penetration depth and energy gap confirm the weak coupling properties of the films. In addition, microwave surface resistances Rs of YBCO/LAO and TBCCO/LAO are also investigated by analysing the quality factor and insert loss of the coplanar resonator. Surface resistance of TBCCO/LAO is less than that of YBCO/LAO, so that TBCCO/LAO films may have more potential applications.

  15. Localization of dexamethasone within dendritic core-multishell (CMS) nanoparticles and skin penetration properties studied by multi-frequency electron paramagnetic resonance (EPR) spectroscopy.

    Science.gov (United States)

    Saeidpour, S; Lohan, S B; Anske, M; Unbehauen, M; Fleige, E; Haag, R; Meinke, M C; Bittl, R; Teutloff, C

    2016-10-15

    The skin and especially the stratum corneum (SC) act as a barrier and protect epidermal cells and thus the whole body against xenobiotica of the external environment. Topical skin treatment requires an efficient drug delivery system (DDS). Polymer-based nanocarriers represent novel transport vehicles for dermal application of drugs. In this study dendritic core-multishell (CMS) nanoparticles were investigated as promising candidates. CMS nanoparticles were loaded with a drug (analogue) and were applied to penetration studies of skin. We determined by dual-frequency electron paramagnetic resonance (EPR) how dexamethasone (Dx) labelled with 3-carboxy-2,2,5,5-tetramethyl-1-pyrrolidinyloxy (PCA) is associated with the CMS. The micro-environment of the drug loaded to CMS nanoparticles was investigated by pulsed high-field EPR at cryogenic temperature, making use of the fact that magnetic parameters (g-, A-matrices, and spin-lattice relaxation time) represent specific probes for the micro-environment. Additionally, the rotational correlation time of spin-labelled Dx was probed by continuous wave EPR at ambient temperature, which provides independent information on the drug environment. Furthermore, the penetration depth of Dx into the stratum corneum of porcine skin after different topical applications was investigated. The location of Dx in the CMS nanoparticles is revealed and the function of CMS as penetration enhancers for topical application is shown.

  16. A combined post-mortem magnetic resonance imaging and quantitative histological study of multiple sclerosis pathology.

    Science.gov (United States)

    Kolasinski, James; Stagg, Charlotte J; Chance, Steven A; Deluca, Gabriele C; Esiri, Margaret M; Chang, Eun-Hyuk; Palace, Jacqueline A; McNab, Jennifer A; Jenkinson, Mark; Miller, Karla L; Johansen-Berg, Heidi

    2012-10-01

    Multiple sclerosis is a chronic inflammatory neurological condition characterized by focal and diffuse neurodegeneration and demyelination throughout the central nervous system. Factors influencing the progression of pathology are poorly understood. One hypothesis is that anatomical connectivity influences the spread of neurodegeneration. This predicts that measures of neurodegeneration will correlate most strongly between interconnected structures. However, such patterns have been difficult to quantify through post-mortem neuropathology or in vivo scanning alone. In this study, we used the complementary approaches of whole brain post-mortem magnetic resonance imaging and quantitative histology to assess patterns of multiple sclerosis pathology. Two thalamo-cortical projection systems were considered based on their distinct neuroanatomy and their documented involvement in multiple sclerosis: lateral geniculate nucleus to primary visual cortex and mediodorsal nucleus of the thalamus to prefrontal cortex. Within the anatomically distinct thalamo-cortical projection systems, magnetic resonance imaging derived cortical thickness was correlated significantly with both a measure of myelination in the connected tract and a measure of connected thalamic nucleus cell density. Such correlations did not exist between these markers of neurodegeneration across different thalamo-cortical systems. Magnetic resonance imaging lesion analysis depicted clearly demarcated subcortical lesions impinging on the white matter tracts of interest; however, quantitation of the extent of lesion-tract overlap failed to demonstrate any appreciable association with the severity of markers of diffuse pathology within each thalamo-cortical projection system. Diffusion-weighted magnetic resonance imaging metrics in both white matter tracts were correlated significantly with a histologically derived measure of tract myelination. These data demonstrate for the first time the relevance of functional

  17. Defining the boarders of extreme life: The study of microbial communities and their settings gives insights into Mars analogue life within the MASE project

    OpenAIRE

    2016-01-01

    The search for life beyond Earth is challenging and requires, as a prerequisite, intensive research on microbial life in similar, extreme environments on Earth. Mars analogue sites are characterised by e.g. anoxic conditions, organic compound limitation, low temperatures, high salinity or presence of oxidising compounds, and consequently represent the chemical and physical borders of life as we know it. The analysis of microorganisms withstanding such conditions is embedded in the European Co...

  18. Synthetic Studies of Didemnaketals Analogue-Construction of the Intermediate (3S,5S,6R)-3,7-Dimethyl-5,6,7-trihydroxy-octanal

    Institute of Scientific and Technical Information of China (English)

    2000-01-01

    An efficient and stereoselective synthetic procedure for (3S,5S,6R)-3,7-dimethyl-5,6,7-trihydroxy-octanal derivative, the intermediate for synthetic of the HIV-active didemnaketals analogue, was developed via a series of reactions from the natural (+)-Pulegone. In this approach, an efficient diastereoselective reaction of the epoxides 8 and 9 with PCC has been accomplished.

  19. Optically Detected Magnetic Resonance and Thermal Activation Spectroscopy Study of Organic Semiconductors

    Energy Technology Data Exchange (ETDEWEB)

    Chang-Hwan Kim

    2003-12-12

    Organic electronic materials are a new class of emerging materials. Organic light emitting devices (OLEDs) are the most promising candidates for future flat panel display technologies. The photophysical characterization is the basic research step one must follow to understand this new class of materials and devices. The light emission properties are closely related to the transport properties of these materials. The objective of this dissertation is to probe the relation between transport and photophysical properties of organic semiconductors. The transport characteristics were evaluated by using thermally stimulated current and thermally stimulated luminescence techniques. The photoluminescence detected magnetic resonance and photoluminescence quantum yield studies provide valuable photophysical information on this class of materials. OLEDs are already in the market. However, detailed studies on the degradation mechanisms are still lacking. Since both optically detected magnetic resonance and thermal activation spectroscopy probe long-lived defect-related states in organic semiconductors, the combined study generates new insight on the OLED operation and degradation mechanisms.

  20. A NEW TOOL FOR THE STUDY OF RESONANCE IN CHEMICAL EDUCATION

    Directory of Open Access Journals (Sweden)

    Francisco Torrens

    2014-03-01

    Full Text Available The objective of this study is to present a computer-based project, for which our program POLAR and our version of PAPID were written for the study of the subject of resonance in chemistry. Both algorithms allow a better didactic strategy and methodological adaptation for the study of molecular properties in chemical education. Teachers will find the options of POLAR and PAPID useful for demonstrations. It is still to be explored the methodological application of these computational programs enriching the present teaching techniques. Implementing new algorithms in learning situations is technically simple, but checking their usefulness in teaching practice is extraordinarily complex and requires a research that has hardly begun. The topic of resonance in chemistry represents an opportunity for the integration of teaching and research into the European Space for Higher Education.

  1. Electron spin resonance studies on reduction process of nitroxyl spin radicals used in molecular imaging

    Energy Technology Data Exchange (ETDEWEB)

    Dhas, M. Kumara; Benial, A. Milton Franklin, E-mail: miltonfranklin@yahoo.com [Department of Physics, NMSSVN College, Nagamalai, Madurai-625019, Tamilnadu (India); Jawahar, A. [Department of Chemistry, NMSSVN College, Nagamalai, Madurai-625019, Tamilnadu (India)

    2014-04-24

    The Electron spin resonance studies on the reduction process of nitroxyl spin probes were carried out for 1mM {sup 14}N labeled nitroxyl radicals in pure water and 1 mM concentration of ascorbic acid as a function of time. The electron spin resonance parameters such as signal intensity ratio, line width, g-value, hyperfine coupling constant and rotational correlation time were determined. The half life time was estimated for 1mM {sup 14}N labeled nitroxyl radicals in 1 mM concentration of ascorbic acid. The ESR study reveals that the TEMPONE has narrowest line width and fast tumbling motion compared with TEMPO and TEMPOL. From the results, TEMPONE has long half life time and high stability compared with TEMPO and TEMPOL radical. Therefore, this study reveals that the TEMPONE radical can act as a good redox sensitive spin probe for molecular imaging.

  2. Studying Kittel-like modes in a 3D YIG disk using Torque-mixing Magnetic Resonance Spectroscopy

    Science.gov (United States)

    Fani Sani, Fatemeh; Losby, Joseph; Grandmont, Dylan; Diao, Zhu; Belov, Miro; Burgess, Jacob; Compton, Shawn; Hiebert, Wayne; Vick, Doug; Mohammad, Kaveh; Salimi, Elham; Bridges, Gregory; Thomson, Douglas; Freeman, Mark

    We report a study of ferrimagnetic resonance in a mesoscopic, single-crystalline YIG disk using torque-mixing magnetic resonance spectroscopy (TMRS). The Kittel model for magnetic resonance is a touchstone in measuring fundamental magnetic properties for magnetic films, which does not significantly depend on the film size. In 3D structures, ladders of confined resonance modes are observed, and these can exhibit the non-monotonic evolution of frequency with field familiar from Kittel modes. TMRS is a tool uniquely suited for observing this physics in individual 3D structures, on account of its combination of high sensitivity and broadband capability coupled with fine frequency resolution.

  3. Ortho-hydroxyl effect and proton transfer via ion-neutral complex: the fragmentation study of protonated imine resveratrol analogues in mass spectrometry.

    Science.gov (United States)

    Yue, Lei; Li, Jing; Xie, Xiaodong; Guo, Cheng; Yin, Xinchi; Yin, Qi; Chen, Yinjuan; Pan, Yuanjiang; Ding, Chuanfan

    2016-07-01

    The fragmentation pathways of protonated imine resveratrol analogues in the gas-phase were investigated by electrospray ionization-tandem mass spectrometry. Benzyl cations were formed in the imine resveratrol analogues that had an ortho-hydroxyl group on the benzene ring A. The specific elimination of the quinomethane neutral, CH2  = C6 H4  = O, from the two isomeric ions [M1 + H](+) and [M3 + H](+) via the corresponding ion-neutral complexes was observed. The fragmentation pathway for the related meta-isomer, ion [M2 + H](+) and the other congeners was not observed. Accurate mass measurements and additional experiments carried out with a chlorinated analogue and the trideuterated isotopolog of M1 supported the overall interpretation of the fragmentation phenomena observed. It is very helpful for understanding the intriguing roles of ortho-hydroxyl effect and ion-neutral complexes in fragmentation reactions and enriching the knowledge of the gas-phase chemistry of the benzyl cation. Copyright © 2016 John Wiley & Sons, Ltd.

  4. Scale-Activity Relationship of MnOx-FeOy Nanocage Catalysts Derived from Prussian Blue Analogues for Low-Temperature NO Reduction: Experimental and DFT Studies.

    Science.gov (United States)

    Yan, Lijun; Liu, Yangyang; Zha, Kaiwen; Li, Hongrui; Shi, Liyi; Zhang, Dengsong

    2017-01-25

    Size effects have been recognized to promote the catalytic activity and selectivity of metal oxide particles. So far, limited works and studies are conducted to investigate the size effect of metal oxide with the tailored shape in the selective catalytic reduction of NOx with NH3 (NH3-SCR). Herein, the MnOx-FeOy nanocage catalysts with varied scales (0.25, 0.5, 1, and 2 μm) were synthesized via a Prussian blue analogue (PBA)-derived method and used for NH3-SCR of NO. By preforming a series of the activity tests over the nanocages with different scales, the NH3-SCR activity of 0.5 μm MnOx-FeOy nanocage catalysts exhibits the highest deNOx activity in the temperature range of 80-200 °C owing to more preferable physical and chemical properties. It has been demonstrated that there is a strong interaction among Mn and Fe cations in the 0.5 μm MnOx-FeOy nanocages. Moreover, the H2-TPR and XPS analysis prove 0.5 μm nanocages exhibit excellent redox properties, which contribute to the higher conservation of NOx. Through the DFT studies, it is also demonstrated that the 0.5 μm MnOx-FeOy nanocage catalysts could provide more preferable electronic charge, which gives rise to the varied adsorption behavior of the NH3 species and NOx species compared to the nanocages with other scales. The in situ DRIFTs were also employed to evaluate the adsorption status of NH3 with NOx species over MnOx-FeOy nanocage catalysts with varied scales. Finally, the scale-activity relationship of the MnOx-FeOy nanocage catalysts and their corresponding activities are also established. The deep insight into the scale-activity relationship of the PBA-derived MnOx-FeOy nanocage catalyst paves the way for developing and designing highly efficient Mn-based catalyst at lower temperature.

  5. Cell-cycle analyses using thymidine analogues in fission yeast.

    Directory of Open Access Journals (Sweden)

    Silje Anda

    Full Text Available Thymidine analogues are powerful tools when studying DNA synthesis including DNA replication, repair and recombination. However, these analogues have been reported to have severe effects on cell-cycle progression and growth, the very processes being investigated in most of these studies. Here, we have analyzed the effects of 5-ethynyl-2'-deoxyuridine (EdU and 5-Chloro-2'-deoxyuridine (CldU using fission yeast cells and optimized the labelling procedure. We find that both analogues affect the cell cycle, but that the effects can be mitigated by using the appropriate analogue, short pulses of labelling and low concentrations. In addition, we report sequential labelling of two consecutive S phases using EdU and 5-bromo-2'-deoxyuridine (BrdU. Furthermore, we show that detection of replicative DNA synthesis is much more sensitive than DNA-measurements by flow cytometry.

  6. Cell-cycle analyses using thymidine analogues in fission yeast.

    Science.gov (United States)

    Anda, Silje; Boye, Erik; Grallert, Beata

    2014-01-01

    Thymidine analogues are powerful tools when studying DNA synthesis including DNA replication, repair and recombination. However, these analogues have been reported to have severe effects on cell-cycle progression and growth, the very processes being investigated in most of these studies. Here, we have analyzed the effects of 5-ethynyl-2'-deoxyuridine (EdU) and 5-Chloro-2'-deoxyuridine (CldU) using fission yeast cells and optimized the labelling procedure. We find that both analogues affect the cell cycle, but that the effects can be mitigated by using the appropriate analogue, short pulses of labelling and low concentrations. In addition, we report sequential labelling of two consecutive S phases using EdU and 5-bromo-2'-deoxyuridine (BrdU). Furthermore, we show that detection of replicative DNA synthesis is much more sensitive than DNA-measurements by flow cytometry.

  7. Holographic Fluids with Vorticity and Analogue Gravity

    CERN Document Server

    Leigh, Robert G; Petropoulos, P Marios

    2012-01-01

    We study holographic three-dimensional fluids with vorticity in local equilibrium and discuss their relevance to analogue gravity systems. The Fefferman-Graham expansion leads to the fluid's description in terms of a comoving and rotating Papapetrou-Randers frame. A suitable Lorentz transformation brings the fluid to the non-inertial Zermelo frame, which clarifies its interpretation as moving media for light/sound propagation. We apply our general results to the Lorentzian Kerr-AdS_4 and Taub-NUT-AdS_4 geometries that describe fluids in cyclonic and vortex flows respectively. In the latter case we associate the appearance of closed timelike curves to analogue optical horizons. In addition, we derive the classical rotational Hall viscosity of three-dimensional fluids with vorticity. Our formula remarkably resembles the corresponding result in magnetized plasmas.

  8. OMERACT Rheumatoid Arthritis Magnetic Resonance Imaging Studies. Exercise 5: an international multicenter reliability study using computerized MRI erosion volume measurements

    DEFF Research Database (Denmark)

    Bird, P; Ejbjerg, B; McQueen, F;

    2003-01-01

    Scoring erosions on magnetic resonance imaging (MRI) is one method of estimating damage in patients with rheumatoid arthritis (RA), but it has limitations. The aim of this pilot study was to assess the feasibility and inter-reader reliability of computer assisted erosion volume estimation...

  9. Semisynthesis of salviandulin E analogues and their antitrypanosomal activity.

    Science.gov (United States)

    Aoyagi, Yutaka; Fujiwara, Koji; Yamazaki, Akira; Sugawara, Naoko; Yano, Reiko; Fukaya, Haruhiko; Hitotsuyanagi, Yukio; Takeya, Koichi; Ishiyama, Aki; Iwatsuki, Masato; Otoguro, Kazuhiko; Yamada, Haruki; Ōmura, Satoshi

    2014-01-15

    A series of analogues of salviandulin E, a rearranged neoclerodane diterpene originally isolated from Salvia leucantha (Lamiaceae), were prepared and their in vitro activity against Trypanosoma brucei brucei was evaluated with currently used therapeutic drugs as positive controls. One of the 19 compounds prepared and assayed in the present study, butanoyl 3,4-dihydrosalviandulin E analogue was found to be a possible candidate for an antitrypanosomal drug with fairly strong antitrypanosomal activity and lower cytotoxicity.

  10. Neurochemical metabolites in the medial prefrontal cortex in bipolar disorder A proton magnetic resonance spectroscopy study

    Institute of Scientific and Technical Information of China (English)

    Osman (O)zdel; Demet Kalayci; Gülfizar S(o)zeri-Varma; Yilmaz Kiro(g)lu; Selim Tümkaya; Tu(g)(c)e Toker-U(g)urlu

    2012-01-01

    The aim of this study was to investigate proton magnetic resonance spectroscopy metabolite values in the medial prefrontal cortex of individuals with euthymic bipolar disorder. The subjects consisted of 15 patients with euthymic bipolar disorder type I and 15 healthy controls. We performed proton magnetic resonance spectroscopy of the bilateral medial prefrontal cortex and measured levels of N-acetyl aspartate, choline and creatine. Levels of these three metabolites in the medial prefrontal cortex were found to be lower in patients with bipolar disorder compared with healthy controls. A positive correlation was found between illness duration and choline levels in the right medial prefrontal cortex. Our study suggests that during the euthymic period, there are abnormalities in cellular energy and membrane phospholipid metabolism in the medial prefrontal cortex, and that this may impair neuronal activity and integrity.

  11. Resonance light scattering spectroscopy study of interaction between gold colloid and thiamazole and its analytical application

    Science.gov (United States)

    Liu, Xiaoling; Yuan, Hong; Pang, Daiwen; Cai, Ruxiu

    2004-01-01

    In this paper, we used resonance light scattering (RLS) spectroscopy to study the interaction between thiol-containing pharmaceutical-thiamazole and gold colloid. At pH 5.2, the resonance light scattering spectrum of gold nanoparticles has a maximum peak at 555 nm and the RLS intensity is enhanced by trace amount of thiamazole due to the interaction between thiamazole and gold colloid. The binding of colloidal gold to thiamazole results in ligand-induced aggregation of colloidal gold, which was characterized by RLS spectrum, ultraviolet-visible (UV-Vis) spectrum, and transmission electron microscopy (TEM). Based upon the study, we proposed a highly sensitive, gold colloid-based assay using RLS spectrum to detect pharmaceuticals for the first time. The mechanism of binding interaction between Au colloid and thiamazole was also discussed.

  12. Formation of ophiolite-bearing tectono-sedimentary mélanges in accretionary wedges by gravity driven submarine erosion: Insights from analogue models and case studies

    Science.gov (United States)

    Malavieille, Jacques; Molli, Giancarlo; Genti, Manon; Dominguez, Stephane; Beyssac, Olivier; Taboada, Alfredo; Vitale-Brovarone, Alberto; Lu, Chia-Yu; Chen, Chih-Tung

    2016-10-01

    Orogenic wedges locally present chaotic tectonostratigraphic units that contain exotic blocks of various size, origin, age and lithology, embedded in a sedimentary matrix. The occurrence of ophiolitic blocks, sometimes huge, in such "mélanges" raises questions on (i) the mechanisms responsible for the incorporation of oceanic basement rocks into an accretionary wedge and (ii) the mechanisms allowing exhumation and redeposition of these exotic elements in "mélanges" during wedge growth. To address these questions, we present the results of a series of analogue experiments performed to characterize the processes and parameters responsible for accretion, exhumation and tectonosedimentary reworking of oceanic basement lithospheric fragments in an accretionary wedge. The experimental setup is designed to simulate the interaction between tectonics, erosion and sedimentation. Different configurations are applied to study the impact of various parameters, such as irregular oceanic floor due to structural inheritance, or the presence of layers with contrasted rheology that can affect deformation partitioning in the wedge (frontal accretion vs basal accretion) influencing its growth. Image correlation technique allows extracting instantaneous velocity field, and tracking of passive particles. By retrieving the particle paths determined from models, the pressure-temperature path of mélange units or elementary blocks can be discussed. The experimental results are then compared with observations from ophiolite-bearing mélanges in Taiwan (Lichi and Kenting mélanges) and Raman spectroscopy of carbonaceous material (RSCM) Thermometry data on rocks from the northern Apennines (Casanova mélange). A geological scenario is proposed following basic observations. The tectonic evolution of the retroside of doubly vergent accretionary wedges is mainly controlled by backthrusting and backfolding. The retro wedge is characterized by steep slopes that are prone to gravitational

  13. Antimicrobial Activity of Resveratrol Analogues

    Directory of Open Access Journals (Sweden)

    Malik Chalal

    2014-06-01

    Full Text Available Stilbenes, especially resveratrol and its derivatives, have become famous for their positive effects on a wide range of medical disorders, as indicated by a huge number of published studies. A less investigated area of research is their antimicrobial properties. A series of 13 trans-resveratrol analogues was synthesized via Wittig or Heck reactions, and their antimicrobial activity assessed on two different grapevine pathogens responsible for severe diseases in the vineyard. The entire series, together with resveratrol, was first evaluated on the zoospore mobility and sporulation level of Plasmopara viticola (the oomycete responsible for downy mildew. Stilbenes displayed a spectrum of activity ranging from low to high. Six of them, including the most active ones, were subsequently tested on the development of Botrytis cinerea (fungus responsible for grey mold. The results obtained allowed us to identify the most active stilbenes against both grapevine pathogens, to compare the antimicrobial activity of the evaluated series of stilbenes, and to discuss the relationship between their chemical structure (number and position of methoxy and hydroxy groups and antimicrobial activity.

  14. Tunnel-diode resonator and nuclear magnetic resonance studies of low-dimensional magnetic and superconducting systems

    Science.gov (United States)

    Yeninas, Steven Lee

    This thesis emphasizes two frequency-domain techniques which uniquely employ radio frequency (RF) excitations to investigate the static and dynamic properties of novel magnetic and superconducting materials. The first technique is a tunnel-diode resonator (TDR) which detects bulk changes in the dynamic susceptibility, chi = dM/dH. The capability of TDR to operate at low temperatures (less than 100 mK) and high fields (up to 65 T in pulsed fields) was critical for investigations of the antiferromagnetically correlated magnetic molecules Cr12Cu2 and Cr12 Ln4 (Ln = Y, Eu, Gd, Tb, Dy, Ho, Er, Yb), and the superconductor SrFe2(As1--xPx) 2 (x = 0.35). Investigations of Cr12Cu 2 and Cr12Ln4 demonstrates the first implementation of TDR to experimentally investigate the lowlying energy spectra of magnetic molecules in pulsed magnetic fields. Zeeman splitting of the quantum spin states results in transitions between field-dependent ground state energy levels observed as peaks in dM/dH at 600 mK, and demonstrate good agreement with theoretical calculations using a isotropic Heisenberg spin Hamiltonian. Increasing temperature to 2.5 K, TDR reveals a rich spectrum of frequency-dependent level crossings from thermally populated excited states which cannot be observed by conventional static magnetometry techniques. The last study presented uses TDR in pulsed fields to determine the temperature-dependent upper-critical field Hc2 to investigate the effects of columnar defects arising from heavy ion irradiation of SrFe2(As 1--xPx)2. Results suggest irradiation uniformly suppresses Tc and Hc2, and does not introduce additional features on H c2(T) and the shapes of the anisotropic Hc2 curves indicates a nodal superconducting gap. The second technique is nuclear magnetic resonance (NMR) which yields site specific magnetic and electronic information arising from hyperfine interactions for select magnetic nuclei. NMR spectra and nuclear spin-lattice relaxation measurements are reported

  15. Evaluation Of Microdosing Strategies For Studies In Preclinical Drug Development: Demonstration Of Linear Pharmacokinetics In Dogs Of A Nucleoside Analogue Over A 50-Fold Dose Range

    Energy Technology Data Exchange (ETDEWEB)

    Sandhu, P; Vogel, J S; Rose, M J; Ubick, E A; Brunner, J E; Wallace, M A; Adelsberger, J K; Baker, M P; Henderson, P T; Pearson, P G; Baillie, T A

    2004-04-22

    (Stafford et al., 1984; Vogel et al., 1990; Smith et al., 1999) to its use as a bioanalytical tool for nutritional research (Buchholz et al., 1999; Deuker et al., 2000; Weaver and Liebman, 2002). Biomedical applications of AMS and its use in the arena of pharmaceutical research also have been detailed in review articles (Barker and Garner, 1999; Garner, 2000; Turteltaub and Vogel, 2000). To date, most studies on the metabolism and disposition of xenobiotics by AMS have focused on how carcinogens bind to DNA and proteins to form adducts (Turteltaub et al., 1990, 1997; Frantz et al., 1995; Dingley et al., 1999; Li et al., 2003). Its application to the field of pharmaceutical sciences has been limited to a few studies (Kaye et al., 1997; Young et al., 2001; Garner et al., 2002). However, the pharmaceutical industry is becoming increasingly aware of the potential benefits that may accrue from the ultra high sensitivity afforded by AMS in terms of evaluating the pharmacokinetics of lead drug candidates in early development. Specifically, AMS allows administration of sub-pharmacological doses (microdoses) of carbon-14 or tritium-labeled investigational drugs to animals or humans at radiologically insignificant levels with the goal of obtaining preliminary information regarding the absorption, distribution, metabolism, and excretion of test compounds (Turteltaub and Vogel, 2000). An unresolved issue, however, is whether the pharmacokinetics determined following a microdose are representative of those following a conventional (pharmacological) dose (Lappin and Garner, 2003). This paper examines the linearity of kinetics of an antiviral nucleoside analogue, Compound A, across sub-pharmacological and pharmacological dose ranges in the dog prior to initiation of a human microdose study. The specific objectives of this study, therefore, were (1) to assess the pharmacokinetics of Compound A in dogs by a conventional dosing approach utilizing LC-MS/MS for sample analysis, (2) to assess

  16. Electron spin resonance study of the demagnetization fields of the ferromagnetic and paramagnetic films

    Directory of Open Access Journals (Sweden)

    I.I. Gimazov, Yu.I. Talanov

    2015-12-01

    Full Text Available The results of the electron spin resonance study of the La1-xCaxMnO3 manganite and the diphenyl-picrylhydrazyl thin films for the magnetic field parallel and perpendicular to plane of the films are presented. The temperature dependence of the demagnetizing field is obtained. The parameters of the Curie-Weiss law are estimated for the paramagnetic thin film.

  17. Magnetic resonance spectroscopy to study hepatic metabolism in diffuse liver diseases, diabetes and cancer

    Institute of Scientific and Technical Information of China (English)

    Pieter; C; Dagnelie; Susanne; Leij-Halfwerk

    2010-01-01

    This review provides an overview of the current state of the art of magnetic resonance spectroscopy (MRS) in in vivo investigations of diffuse liver disease. So far, MRS of the human liver in vivo has mainly been used as a research tool rather than a clinical tool. The liver is particularly suitable for static and dynamic metabolic studies due to its high metabolic activity. Furthermore, its relatively superfi cial position allows excellent MRS localization, while its large volume allows detection of signal...

  18. Solid state nuclear magnetic resonance studies of prion peptides and proteins

    Energy Technology Data Exchange (ETDEWEB)

    Heller, Jonathan [Univ. of California, Berkeley, CA (United States)

    1997-08-01

    High-resolution structural studies using x-ray diffraction and solution nuclear magnetic resonance (NMR) are not feasible for proteins of low volubility and high tendency to aggregate. Solid state NMR (SSNMR) is in principle capable of providing structural information in such systems, however to do this efficiently and accurately, further SSNMR tools must be developed This dissertation describes the development of three new methods and their application to a biological system of interest, the priori protein (PrP).

  19. Freezing and melting of water in porous geomaterials studied by magnetic resonance

    OpenAIRE

    2010-01-01

    We intend to study mechanical effects of freezing and thawing on bulky samples of concrete by nuclear resonance high resolution spectroscopy and imaging (MRI). Variously functionalised three dimensional images of liquid water in the porous media can be obtained by MRI. NMR spectroscopy, on the other hand, can be used to directly measure the total quantity of liquid water as a function of temperature. Moreover, measurements of magnetic spin relaxation rates and diffusion can provide info...

  20. A functional magnetic resonance imaging study mapping the episodic memory encoding network in temporal lobe epilepsy

    OpenAIRE

    Sidhu, Meneka K; Stretton, Jason; Winston, Gavin P.; Bonelli, Silvia; Centeno, Maria; Vollmar, Christian; Symms, Mark; Thompson, Pamela J; Koepp, Matthias J; Duncan, John S.

    2013-01-01

    Functional magnetic resonance imaging has demonstrated reorganization of memory encoding networks within the temporal lobe in temporal lobe epilepsy, but little is known of the extra-temporal networks in these patients. We investigated the temporal and extra-temporal reorganization of memory encoding networks in refractory temporal lobe epilepsy and the neural correlates of successful subsequent memory formation. We studied 44 patients with unilateral temporal lobe epilepsy and hippocampal sc...

  1. Alpha-resonance structure in $^{11}$C studied via resonant scattering of $^{7}$Be+$\\alpha$ and $^{7}$Be($\\alpha$, $p$) reaction

    CERN Document Server

    Yamaguchi, H; Wakabayashi, Y; Kubono, S; Hashimoto, T; Hayakawa, S; Kawabata, T; Iwasa, N; Teranishi, T; Kwon, Y K; Binh, D N; Khiem, L H; Duy, N N

    2012-01-01

    The resonance structure in $^{11}$C is particularly of interest with regard to the astrophysical $^{7}$Be($\\alpha$, $\\gamma$) reaction, relevant at high temperature, and to the $\\alpha$-cluster structure in $^{11}$C. The measurement was to determine unknown resonance parameters for the high excited states of $^{11}$C. In particular, the $\\alpha$ decay width can be useful information to discuss $\\alpha$ cluster structure in $^{11}$C. New measurements of the $^{7}$Be+$\\alpha$ resonant scattering and the $^{7}$Be($\\alpha$, $p$)$^{10}$B reaction in inverse kinematics were performed for center-of-mass energy up to 5.5 MeV, and the resonances at excitation energies of 8.9--12.7 MeV in the compound $^{11}$C nucleus were studied. Inelastic scattering of $^{7}$Be+$\\alpha$ and the $^{7}$Be($\\alpha$, $p_1$)$^{10}$B$^*$ reaction were also studied with a simultaneous $\\gamma$-ray measurement. The measurements were performed at the low-energy RI beam facility CRIB (CNS Radioactive Ion Beam separator) of the Center for Nucl...

  2. Free Surface Waves And Interacting Bouncing Droplets: A Parametric Resonance Case Study

    KAUST Repository

    Borja, Francisco J.

    2013-07-01

    Parametric resonance is a particular type of resonance in which a parameter in a system changes with time. A particularly interesting case is when the parameter changes in a periodic way, which can lead to very intricate behavior. This di↵ers from periodic forcing in that solutions are not necessarily periodic. A system in which parametric resonance is realized is when a fluid bath is shaken periodically, which leads to an e↵ective time dependent gravitational force. This system will be used to study the onset of surface waves in a bath with non-uniform topography. A linear model for the surface waves is derived from the Euler equations in the limit of shallow waves, which includes the geometry of the bottom and surface tension. Experiments are performed to compare with the proposed model and good qualitative agreement is found. Another experiment which relies on a shaking fluid bath is that of bouncing fluid droplets. In the case of two droplets the shaking allows for a larger bouncing droplet to attract a smaller moving droplet in a way that creates a bound system. This bound system is studied and shows some analogous properties to quantum systems, so a quantum mechanical model for a two dimensional atom is studied, as well as a proposed model for the droplet-wave system in terms of equations of fluid mechanics.

  3. Insulin analogues in pregnancy and specific congenital anomalies

    DEFF Research Database (Denmark)

    de Jong, Josta; Garne, Ester; Wender-Ozegowska, Ewa

    2016-01-01

    in the congenital anomaly rate among foetuses exposed to insulin analogues (lispro, aspart, glargine or detemir) compared with those exposed to human insulin or Neutral Protamine Hagedorn insulin. The total prevalence of congenital anomalies was not increased for foetuses exposed to insulin analogues. The small...... included 1286 foetuses of mothers using short-acting insulin analogues with 1089 references of mothers using human insulin and 768 foetuses of mothers using long-acting insulin analogues with 685 references of mothers using long-acting human insulin (Neutral Protamine Hagedorn). The congenital anomaly rate...... samples in the included studies provided insufficient statistical power to identify a moderate increased risk of specific congenital anomalies. Copyright © 2015 John Wiley & Sons, Ltd....

  4. Automated Layout Generation of Analogue and Mixed-Signal ASIC's

    DEFF Research Database (Denmark)

    Bloch, Rene

    The research and development carried out in this Ph.D. study focusses on two key areas of the design flow for analogue and mixed-signal integrated circuit design, the mixed-signal floorplanning and the analogue layout generation.A novel approach to floorplanning is presented which provides true...... flow.A new design flow for automated layout generation of general analogue integrated circuits is presented. The design flow provides an automated design path from a sized circuit schematic to the final layout containing the placed, but unrouted, devices of the circuit. The analogue circuit layout...... interactive floorplanning capabilities due to a new implementation variant of a Genetic Algorithm. True interactive floorplanning allows the designer to communicate with existing floorplans during optimization. By entering the "ideas" and expertise of the designer into the optimization algorithm the automated...

  5. From BPA to its analogues: Is it a safe journey?

    Science.gov (United States)

    Usman, Afia; Ahmad, Masood

    2016-09-01

    Bisphenol-A (BPA) is one of the most abundant synthetic chemicals in the world due to its uses in plastics. Its widespread exposure vis-a-vis low dose effects led to a reduction in its safety dose and imposition of ban on its use in infant feeding bottles. This restriction paved the way for the gradual market entry of its analogues. However, their structural similarity to BPA has put them under surveillance for endocrine disrupting potential. The application of these analogues is increasing and so are the studies reporting their toxicity. This review highlights the reasons which led to the ban of BPA and also reports the exposure and toxicological data available on its analogues. Hence, this compilation is expected to answer in a better way whether the replacement of BPA by these analogues is safer or more harmful?

  6. Thymidine analogues for tracking DNA synthesis.

    Science.gov (United States)

    Cavanagh, Brenton L; Walker, Tom; Norazit, Anwar; Meedeniya, Adrian C B

    2011-09-15

    Replicating cells undergo DNA synthesis in the highly regulated, S-phase of the cell cycle. Analogues of the pyrimidine deoxynucleoside thymidine may be inserted into replicating DNA, effectively tagging dividing cells allowing their characterisation. Tritiated thymidine, targeted using autoradiography was technically demanding and superseded by 5-bromo-2-deoxyuridine (BrdU) and related halogenated analogues, detected using antibodies. Their detection required the denaturation of DNA, often constraining the outcome of investigations. Despite these limitations BrdU alone has been used to target newly synthesised DNA in over 20,000 reviewed biomedical studies. A recent breakthrough in "tagging DNA synthesis" is the thymidine analogue 5-ethynyl-2'-deoxyuridine (EdU). The alkyne group in EdU is readily detected using a fluorescent azide probe and copper catalysis using 'Huisgen's reaction' (1,3-dipolar cycloaddition or 'click chemistry'). This rapid, two-step biolabelling approach allows the tagging and imaging of DNA within cells whilst preserving the structural and molecular integrity of the cells. The bio-orthogonal detection of EdU allows its application in more experimental assays than previously possible with other "unnatural bases". These include physiological, anatomical and molecular biological experimentation in multiple fields including, stem cell research, cancer biology, and parasitology. The full potential of EdU and related molecules in biomedical research remains to be explored.

  7. Thymidine Analogues for Tracking DNA Synthesis

    Directory of Open Access Journals (Sweden)

    Brenton L. Cavanagh

    2011-09-01

    Full Text Available Replicating cells undergo DNA synthesis in the highly regulated, S-phase of the cell cycle. Analogues of the pyrimidine deoxynucleoside thymidine may be inserted into replicating DNA, effectively tagging dividing cells allowing their characterisation. Tritiated thymidine, targeted using autoradiography was technically demanding and superseded by 5-bromo-2-deoxyuridine (BrdU and related halogenated analogues, detected using antibodies. Their detection required the denaturation of DNA, often constraining the outcome of investigations. Despite these limitations BrdU alone has been used to target newly synthesised DNA in over 20,000 reviewed biomedical studies. A recent breakthrough in “tagging DNA synthesis” is the thymidine analogue 5-ethynyl-2′-deoxyuridine (EdU. The alkyne group in EdU is readily detected using a fluorescent azide probe and copper catalysis using ‘Huisgen’s reaction’ (1,3-dipolar cycloaddition or ‘click chemistry’. This rapid, two-step biolabelling approach allows the tagging and imaging of DNA within cells whilst preserving the structural and molecular integrity of the cells. The bio-orthogonal detection of EdU allows its application in more experimental assays than previously possible with other “unnatural bases”. These include physiological, anatomical and molecular biological experimentation in multiple fields including, stem cell research, cancer biology, and parasitology. The full potential of EdU and related molecules in biomedical research remains to be explored.

  8. Introduction to electronic analogue computers

    CERN Document Server

    Wass, C A A

    1965-01-01

    Introduction to Electronic Analogue Computers, Second Revised Edition is based on the ideas and experience of a group of workers at the Royal Aircraft Establishment, Farnborough, Hants. This edition is almost entirely the work of Mr. K. C. Garner, of the College of Aeronautics, Cranfield. As various advances have been made in the technology involving electronic analogue computers, this book presents discussions on the said progress, including some acquaintance with the capabilities of electronic circuits and equipment. This text also provides a mathematical background including simple differen

  9. Studies on a Q/A selector for the SECRAL electron cyclotron resonance ion source

    Science.gov (United States)

    Yang, Y.; Sun, L. T.; Feng, Y. C.; Fang, X.; Lu, W.; Zhang, W. H.; Cao, Y.; Zhang, X. Z.; Zhao, H. W.

    2014-08-01

    Electron cyclotron resonance ion sources are widely used in heavy ion accelerators in the world because they are capable of producing high current beams of highly charged ions. However, the design of the Q/A selector system for these devices is challenging, because it must have a sufficient ion resolution while controlling the beam emittance growth. Moreover, this system has to be matched for a wide range of ion beam species with different intensities. In this paper, research on the Q/A selector system at the SECRAL (Superconducting Electron Cyclotron Resonance ion source with Advanced design in Lanzhou) platform both in experiment and simulation is presented. Based on this study, a new Q/A selector system has been designed for SECRAL II. The features of the new design including beam simulations are also presented.

  10. Magnetic resonance imaging (MRI: a technique to study flow an microstructure of concentrated emulsions

    Directory of Open Access Journals (Sweden)

    M. A. d'Avila

    2005-03-01

    Full Text Available Nuclear magnetic resonance (NMR and magnetic resonance imaging (MRI have recently been recognized as important techniques for R&D of products and processes, as is attested by several successful applications in different areas of chemical engineering in recent years. In this article we present new experimental methods based on MRI to study flow and microstructure of concentrated emulsions. The objective is to present the unique features of this noninvasive technique to accurately measure different properties of flowing particulate opaque systems. Experimental results of velocity profiles, spatial distribution of droplet sizes and spatial homogeneity of an oil-in-water dispersion in a horizontal, concentric cylinder geometry using different pulse sequences are presented. The application of these techniques allowed probing important information on flow and microstructure of multiphase systems of interest in chemical engineering and food science.

  11. Relationship between calcifying tendinitis and subacromial impingement: a prospective radiography and magnetic resonance imaging study.

    Science.gov (United States)

    Loew, M; Sabo, D; Wehrle, M; Mau, H

    1996-01-01

    In a prospective study radiographs and magnetic resonance images of 75 patients with calcifying tendinitis of the rotator cuff were analyzed. The aim was to evaluate any relation between calcifying tendinitis and subacromial impingement. A total of 83% of the calcifications were located in the supraspinatus or the adjoining part of the subscapularis tendon. On T1-weighted images they could be demonstrated with high accuracy as areas of decreased signal intensity. A magnetic resonance imaging categorization of the calcium deposits was carried out by means of a differentiation of form, outline, and density. A partial rotator cuff tear was found in one shoulder; in 11% variable aspects of degenerative alteration of the affected tendon were seen. By analysis of the radiographic outlet view 16% of the cases had a type III acromion. In conclusion, little correlation exists between calcifying tendinitis and additional findings associated with subacromial impingement.

  12. Studies on a Q/A selector for the SECRAL electron cyclotron resonance ion source.

    Science.gov (United States)

    Yang, Y; Sun, L T; Feng, Y C; Fang, X; Lu, W; Zhang, W H; Cao, Y; Zhang, X Z; Zhao, H W

    2014-08-01

    Electron cyclotron resonance ion sources are widely used in heavy ion accelerators in the world because they are capable of producing high current beams of highly charged ions. However, the design of the Q/A selector system for these devices is challenging, because it must have a sufficient ion resolution while controlling the beam emittance growth. Moreover, this system has to be matched for a wide range of ion beam species with different intensities. In this paper, research on the Q/A selector system at the SECRAL (Superconducting Electron Cyclotron Resonance ion source with Advanced design in Lanzhou) platform both in experiment and simulation is presented. Based on this study, a new Q/A selector system has been designed for SECRAL II. The features of the new design including beam simulations are also presented.

  13. The clinical study on high intensity zone of magnetic resonance imaging using Scolopendrid Aquacupuncture.

    Directory of Open Access Journals (Sweden)

    Jeong-a Lim

    2006-12-01

    Full Text Available Objective : This study was designed to find out the effect of scolopendrid aquacupuncture on low back pain with or without sciatica showing high intensity zone of magnetic resonance imaging. Methods : The 30 patients who had a diagnosis of high intensity zone by lumbar-MRI and admitted to Gwangju oriental medical hospital in wonkwang university from January 2005 to August 2004 were observed. The symptom of inpatients is low back pain with or without sciatica. We treated 30 patients by scolopendrid aquacupuncture besides the general conservative treatment of oriental medicine. Results and Conclusion : The scolopendrid aquacupuncture treatment led to improvement in the pain and symptom of disability as determined by all efficacy measures. After scolopendrid aquacupuncture treatment, there was improvement in VAS, ROM and SLRT. This results suggest that scolopendrid aquacupuncture is good method for treatment of low back pain with or without sciatica showing high intensity zone of magnetic resonance imaging.

  14. Analogue Methods in Palaeoecology: Using the analogue Package

    Directory of Open Access Journals (Sweden)

    Gavin L. Simpson

    2007-08-01

    Full Text Available Palaeoecology is an important branch of ecology that uses the subfossil remains of organisms preserved in lake, ocean and bog sediments to inform on changes in ecosystems and the environment through time. The analogue package contains functions to perform modern analogue technique (MAT transfer functions, which can be used to predict past changes in the environment, such as climate or lake-water pH from species data. A related technique is that of analogue matching, which is concerned with identifying modern sites that are floristically and faunistically similar to fossil samples. These techniques, and others, are increasingly being used to inform public policy on environmental pollution and conservation practices. These methods and other functionality in analogue are illustrated using the Surface Waters Acidification Project diatom:pH training set and diatom counts on samples of a sediment core from the Round Loch of Glenhead, Galloway, Scotland. The paper is aimed at palaeoecologists who are familiar with the techniques described but not with R.

  15. [Value of the nuclear magnetic cholangio resonance in the study of the patient with jaundice].

    Science.gov (United States)

    Gramática, L; Struni, M; Carranza, D; Verasay, G; Taborda, B; Caballero, F; Gramática, L

    1999-01-01

    This report analyse the results about forty three (43) patients, thirty six (36) of which showed an extrahepatic obstructive biliary Syndrome was made evident by ultrasonography, five (5) with a cholecistolithiasis and doubtful history of jaundice were evaluated to carry out a video-surgery procedure and two (2) patients whom hepatic-yeyunostomy had been practiced, a control of anastomosis in postoperative period was required. Nuclear Magnetic Resonance and Operative Cholangiography findings were correlated and afterward with the anatomopathological studies when they arrived. In all cases the Nuclear Magnetic Cholangio Resonance (NMCR) let us prove the diagnosis of extrahepatic biliary obstruction determining with precision furthermore the topographical site of the lesion. Respecting the aetiology of obstruction, NMCR was accurate in 34 out of 36 cases (94.4%). In conclusion Cholangio-Resonance is an excellent diagnostic method to evaluate biliary ductal system including anatomic changes. However, there are some limitations yet in order to determine the aetiology of lesions about extrahepatic biliary via extremes. We emphasize its features such as non-invasive, little operating dependent, and without morbimortality that become it as a method of choice to study the biliary via from a diagnostic viewpoint.

  16. Condensed matter analogues of cosmology

    Science.gov (United States)

    Kibble, Tom; Srivastava, Ajit

    2013-10-01

    liveliest. A number of new experiments are reported here studying the dynamical evolution of domains and defects. Another phenomenon that played a key early role was the formation of vortices in the normal-to-superfluid transition in liquid helium-3. The complicated nature of the order parameter energy surface gives rise to a variety of intriguing effects. This too is still a vigorous field. Superconductivity is a special case because the symmetry that is broken is a gauge symmetry. This is also true in fundamental particle physics theories of relevance to cosmology, and for that reason experiments on superconductors are of particular interest to cosmologists. The situation in this case is more complicated because there are competing mechanisms of defect formation. Experiments in the field have not proved easy, either to perform or to interpret, but the papers in this collection show that good progress has been made of late. In recent years a new type of system has proved immensely fruitful, namely atomic Bose-Einstein or Fermi-gas condensates. Experiments on condensates with tunable parameters have in general provided broad support for the theory, and have also revealed a wide range of interesting and novel features, with intriguing possible analogues in cosmology (e.g. causal horizons and particle creation). The basic idea of the Kibble-Zurek mechanism has been shown to be relevant in this whole range of systems. But numerous complexities have also emerged, concerned for example with the role of inhomogeneity or the existence of composite defects. The field is still developing rapidly. Acknowledgments Finally, we would like to thank all the authors who have contributed to this issue, and the staff of Journal of Physics: Condensed Matter who have made it possible. Condensed matter analogues of cosmology contents Condensed matter analogues of cosmologyTom Kibble and Ajit Srivastava Symmetry breaking in nematic liquid crystals: analogy with cosmology and magnetismR Repnik, A

  17. Maturation of limbic regions in Asperger syndrome: a preliminary study using proton magnetic resonance spectroscopy and structural magnetic resonance imaging.

    Science.gov (United States)

    O'Brien, Finian M; Page, Lisa; O'Gorman, Ruth L; Bolton, Patrick; Sharma, Ajay; Baird, Gillian; Daly, Eileen; Hallahan, Brian; Conroy, Ronán M; Foy, Catherine; Curran, Sarah; Robertson, Dene; Murphy, Kieran C; Murphy, Declan G M

    2010-11-30

    People with autistic spectrum disorders (ASD, including Asperger syndrome) may have developmental abnormalities in the amygdala-hippocampal complex (AHC). However, in vivo, age-related comparisons of both volume and neuronal integrity of the AHC have not yet been carried out in people with Asperger syndrome (AS) versus controls. We compared structure and metabolic activity of the right AHC of 22 individuals with AS and 22 healthy controls aged 10-50 years and examined the effects of age between groups. We used structural magnetic resonance imaging (sMRI) to measure the volume of the AHC, and magnetic resonance spectroscopy ((1)H-MRS) to measure concentrations of N-acetyl aspartate (NAA), creatine+phosphocreatine (Cr+PCr), myo-inositol (mI) and choline (Cho). The bulk volume of the amygdala and the hippocampus did not differ significantly between groups, but there was a significant difference in the effect of age on the hippocampus in controls. Compared with controls, young (but not older) people with AS had a significantly higher AHC concentration of NAA and a significantly higher NAA/Cr ratio. People with AS, but not controls, had a significant age-related reduction in NAA and the NAA/Cr ratio. Also, in people with AS, but not controls, there was a significant relationship between concentrations of choline and age so that choline concentrations reduced with age. We therefore suggest that people with AS have significant differences in neuronal and lipid membrane integrity and maturation of the AHC.

  18. Study of resonant modes in a 700 nm pitch macroporous silicon photonic crystal

    Science.gov (United States)

    Cardador, D.; Vega, D.; Segura, D.; Rodríguez, A.

    2017-01-01

    In this study the modes produced by a defect inserted in a macroporous silicon (MP) photonic crystal (PC) have been studied theoretical and experimentally. In particular, the transmitted and reflected spectra have been analyzed for variations in the defect's length and width. The performed simulations show that the resonant frequency is more easily adjusted for the fabricated samples by length tuning rather than width. The optimum resonance peak results when centered in the PC bandgap. The changes in the defect geometry result in small variations of the optical response of the PC. The resonance frequency is most sensitive to length variations, while the mode linewidth shows greater change with the defect width variation. Several MPS photonic crystals were fabricated by the electrochemical etching (EE) process with optical response in the range of 5.8 μm to 6.5 μm. Results of the characterization are in good agreement with simulations. Further samples were fabricated consisting of ordered modulated pores with a pitch of 700 nm. This allowed to reduce the vertical periodicity and therefore to have the optical response in the range of 4.4 μm to 4.8 μm. To our knowledge, modes working in this range of wavelengths have not been previously reported in 3-d MPS structures. Experimental results match with simulations, showing a linear relationship between the defect's length and working frequency inside the bandgap. We demonstrate the possibility of tailoring the resonance peak in both ranges of wavelengths, where the principal absorption lines of different gases in the mid infrared are placed. This makes these structures very promising for their application to compact gas sensors.

  19. Study of nuclear reactions and analog isobar states in the system He{sup 8} + p for low energy with the help of MAYA active target; Etude de reactions et d'etats isobariques analogues dans le systeme {sup 8}He+p, a basse energie a l'aide de la cible active MAYA

    Energy Technology Data Exchange (ETDEWEB)

    Demonchy, Ch.E

    2003-12-01

    With the resent improvements in the field of exotics beams, and specially with the SPIRAL facility at GANIL, we were able to study He{sup 9} shell inversion already known for Be{sup 11} and Li{sup 10}, which are two members of the N=7 family. A new detector was developed and also the software tools for the data analysis. This detector is at the same time the target (active-target) and is called MAYA. The He{sup 9} was studied by determining the properties of its isobaric analogue states in Li{sup 9}. The characteristics of the IAS (isomeric analog state) states were determined by an analysis of the resonances in the elastic scattering cross section for He{sup 8} + p from 2 up to 3.9 MeV/n. A study of (p,d) and (p,t) reactions was done too, in this domain of energy. By comparing the experimental results with calculations, an assignation of spin and parity for two states in He{sup 9} was possible. (author)

  20. Organobase catalyzed 1,4-conjugate addition of 4-hydroxycoumarin on chalcones: Synthesis, NMR and single-crystal X-ray diffraction studies of novel warfarin analogues

    Science.gov (United States)

    Talhi, Oualid; Fernandes, José A.; Pinto, Diana C. G. A.; Almeida Paz, Filipe A.; Silva, Artur M. S.

    2015-08-01

    The synthesis of a new series of warfarin analogues by convenient organobase catalyzed 1,4-conjugate addition of 4-hydroxycoumarin to chalcone derivatives is described. 1H NMR spectroscopy evidenced the presence of a predominant acyclic open-form together with the cyclic hemiketal tautomers of the resulting Michael adducts. The acyclic open-form has been unequivocally proved by single-crystal X-ray diffraction analysis. The use of the B ring ortho-hydroxychalcone synthons in this reaction has led to a diastereoselective synthesis of warfarin bicyclo[3.3.1]nonane ketal derivatives.

  1. Outcrop analogue study of Permocarboniferous geothermal sandstone reservoir formations (northern Upper Rhine Graben, Germany): impact of mineral content, depositional environment and diagenesis on petrophysical properties

    Science.gov (United States)

    Aretz, Achim; Bär, Kristian; Götz, Annette E.; Sass, Ingo

    2016-07-01

    The Permocarboniferous siliciclastic formations represent the largest hydrothermal reservoir in the northern Upper Rhine Graben in SW Germany and have so far been investigated in large-scale studies only. The Cenozoic Upper Rhine Graben crosses the Permocarboniferous Saar-Nahe Basin, a Variscan intramontane molasse basin. Due to the subsidence in this graben structure, the top of the up to 2-km-thick Permocarboniferous is located at a depth of 600-2900 m and is overlain by Tertiary and Quaternary sediments. At this depth, the reservoir temperatures exceed 150 °C, which are sufficient for geothermal electricity generation with binary power plants. To further assess the potential of this geothermal reservoir, detailed information on thermophysical and hydraulic properties of the different lithostratigraphical units and their depositional environment is essential. Here, we present an integrated study of outcrop analogues and drill core material. In total, 850 outcrop samples were analyzed, measuring porosity, permeability, thermal conductivity and thermal diffusivity. Furthermore, 62 plugs were taken from drillings that encountered or intersected the Permocarboniferous at depths between 1800 and 2900 m. Petrographic analysis of 155 thin sections of outcrop samples and samples taken from reservoir depth was conducted to quantify the mineral composition, sorting and rounding of grains and the kind of cementation. Its influence on porosity, permeability, the degree of compaction and illitization was quantified. Three parameters influencing the reservoir properties of the Permocarboniferous were detected. The strongest and most destructive influence on reservoir quality is related to late diagenetic processes. An illitic and kaolinitic cementation and impregnation of bitumina document CO2- and CH4-rich acidic pore water conditions, which are interpreted as fluids that migrated along a hydraulic contact from an underlying Carboniferous hydrocarbon source rock. Migrating

  2. A study of Helmholtz resonators to stabilize thermoacoustically driven pressure oscillations.

    Science.gov (United States)

    Zalluhoglu, Umut; Olgac, Nejat

    2016-04-01

    This paper studies passive control of thermoacoustic instabilities from an unconventional mathematical perspective. These instabilities are notoriously known to result from the complex dynamic exchange between the unsteady heat release and the acoustic waves within a finite volume such as a combustor. One possible passive control strategy is to utilize Helmholtz resonators. Under certain simplifications, the ensemble combustion dynamics including the resonators reduces to a linear-time invariant-multiple time-delayed system (LTI-MTDS). As the main contribution of the paper, an exact analytical procedure is proposed to determine the placement of the resonators to avoid instabilities. A unique mathematical paradigm, called the cluster treatment of characteristic roots, is used to accomplish this task. It declares exactly the necessary and sufficient stability conditions for an LTI-MTDS in the space of the system parameters. This concept paper is written with the mindset that this analytical tool can invite yet unexplored design capabilities for similar noise control applications where acoustic dampers are used.

  3. Design study of electron cyclotron resonance-ion plasma accelerator for heavy ion cancer therapy

    Energy Technology Data Exchange (ETDEWEB)

    Inoue, T., E-mail: ttinoue@juntendo.ac.jp; Sugimoto, S.; Sasai, K. [Graduate School of Medicine, Juntendo University, Tokyo 113–8421 (Japan); Hattori, T. [National Institute of Radiological Sciences, Chiba 263–0024 (Japan)

    2014-02-15

    Electron Cyclotron Resonance-Ion Plasma Accelerator (ECR-IPAC) device, which theoretically can accelerate multiple charged ions to several hundred MeV with short acceleration length, has been proposed. The acceleration mechanism is based on the combination of two physical principles, plasma electron ion adiabatic ejection (PLEIADE) and Gyromagnetic Autoresonance (GYRAC). In this study, we have designed the proof of principle machine ECR-IPAC device and simulated the electromagnetic field distribution generating in the resonance cavity. ECR-IPAC device consisted of three parts, ECR ion source section, GYRAC section, and PLEIADE section. ECR ion source section and PLEIADE section were designed using several multi-turn solenoid coils and sextupole magnets, and GYRAC section was designed using 10 turns coil. The structure of ECR-IPAC device was the cylindrical shape, and the total length was 1024 mm and the maximum diameter was 580 mm. The magnetic field distribution, which maintains the stable acceleration of plasma, was generated on the acceleration center axis throughout three sections. In addition, the electric field for efficient acceleration of electrons was generated in the resonance cavity by supplying microwave of 2.45 GHz.

  4. Domain structure and magnetic resonance studies of ferroelastic BiVO4 revisited

    Science.gov (United States)

    Choh, Sung Ho; Jang, Min Su

    2016-04-01

    Bismuth vanadate (BiVO4) is a ferroelastic material undergoing a reversible second order phase transition at 528 K(T c) between the tetragonal and monoclinic structure. There have been experimental studies on the incommensurate domain wall (W‧) which reported different orientation angles. In order to clarify this we have tried to calculate it numerically in terms of lattice constants above and below T c by employing the theory of Sapriel, and obtained it to be either 35.9° or 54.1°. It also turns out that the shear strain (S 21) in the ferroelastic phase depends on the crystal growing condition. The remaining internal stress appears to be responsible for the formation of W‧ wall. The host atom nuclear magnetic resonance and the S-state impurity electron magnetic resonance are also reviewed. The nuclear electric quadrupole interaction of 51V and 209Bi in BiVO4 was evaluated in terms of the point charge model based on the crystal structure. The result of electric field gradient tensor turns out to be reasonable with experimental values. The zero-field splitting tensor of Mn2+, Fe3+ and Gd3+ are also compared, and the deduced local environment of these ions in the host are confirmed. Finally the second-order phase transition according to the Landau’s framework is found in this crystal from the temperature dependence of magnetic resonance parameters. Supported by The National Academy of Sciences, Republic of Korea (2014) through SHC.

  5. Study of fluid resonance between two side-by-side floating barges

    Institute of Scientific and Technical Information of China (English)

    李欣; 徐亮瑜; 杨建民

    2016-01-01

    The hydrodynamic interaction between two vessels in a side-by-side configuration attracted research attentions in recent years. However, because the conventional potential flow theory does not consider the fluid viscosity, in the hydrodynamic results, the wave elevations were overestimated in the narrow gap under resonance conditions. To overcome this limitation and investigate the complex fluid flow around multiple bodies in detail, this study examines the fluid resonance between two identical floating barges using a viscous flow analysis program FLOW-3D. The volume of fluid method is implemented for tracking the free surface, and a porous media model is used near the outflow boundary to enhance the wave absorption. A three-dimensional numerical wave basin is established and validated by comparison with the waves generated using theoretical values. On this basis, a computational fluid dynamics (CFD) simulation of the two barges in a resonance wave period is performed, and the wave elevations, the fluid flow around the barges, and the motions of the barges are discussed. The numerical simulation is verified by comparison with results of corresponding experimental data.

  6. Study of dual wavelength composite output of solid state laser based on adjustment of resonator parameters

    Science.gov (United States)

    Wang, Lei; Nie, Jinsong; Wang, Xi; Hu, Yuze

    2016-10-01

    The 1064nm fundamental wave (FW) and the 532nm second harmonic wave (SHW) of Nd:YAG laser have been widely applied in many fields. In some military applications requiring interference in both visible and near-infrared spectrum range, the de-identification interference technology based on the dual wavelength composite output of FW and SHW offers an effective way of making the device or equipment miniaturized and low cost. In this paper, the application of 1064nm and 532nm dual-wavelength composite output technology in military electro-optical countermeasure is studied. A certain resonator configuration that can achieve composite laser output with high power, high beam quality and high repetition rate is proposed. Considering the thermal lens effect, the stability of this certain resonator is analyzed based on the theory of cavity transfer matrix. It shows that with the increase of thermal effect, the intracavity fundamental mode volume decreased, resulting the peak fluctuation of cavity stability parameter. To explore the impact the resonator parameters does to characteristics and output ratio of composite laser, the solid-state laser's dual-wavelength composite output models in both continuous and pulsed condition are established by theory of steady state equation and rate equation. Throughout theoretical simulation and analysis, the optimal KTP length and best FW transmissivity are obtained. The experiment is then carried out to verify the correctness of theoretical calculation result.

  7. Electron paramagnetic resonance studies of beta-alumina, a prototype glass

    Energy Technology Data Exchange (ETDEWEB)

    Kurtz, Steven Ross

    1980-01-01

    Electron paramagnetic resonance techniques are used to study single crystal Na, K, and Li beta-alumina. Color centers are introduced into this material by irradiating the samples with electrons at liquid nitrogen temperature. Using electron paramagnetic resonance and electron nuclear double resonance, the color centers generated in this manner are identified, and their location within the material is determined. For one of these centers, an F/sup +/ center, the electron spin relaxation rate is measured over the range 2 to 20/sup 0/K using the pulse saturation and recovery technique. These measurements reveal an exceptionally fast relaxation rate with anomalous temperature and microwave frequency dependence. Beta-alumina is a structurally unique system. It is partially disordered and consists of ordered blocks of aluminum oxide separated by planar disordered regions. Extensive measurements have shown that beta-alumina displays properties identical to those observed for glasses at low temperature as a result of this limited structural disorder. These glass-like properties have been explained by proposing that atomic tunneling occurs in beta-alumina at low temperature producing a system of localized two level states. A model is developed which quantitatively describes the electron spin relaxation data. The proposed relaxation mechanism couples the color center spin to the phonon induced relaxation of a nearby localized two level tunneling state. A detailed comparison shows that this model is in good agreement with earlier heat capacity, thermal conductivity, and dielectric susceptibility measurements in beta-alumina.

  8. Microwave sintering studies on low loss (Zn, Mg)TiO3 dielectric resonator materials.

    Science.gov (United States)

    Sirugudu, Roopas Kiran; Vemuri, Rama Krishna Murthy; Murty, B S

    2013-01-01

    Low dielectric loss Zn07Mg0.3TiO3 and MgTiO3 microwave dielectric resonators were prepared by the conventional solid state reaction method. The microwave interaction with these materials has been studied using both single-mode and multimode microwave furnaces operating at a frequency of 2.45 GHz. Microwave sintering could be achieved using a multimode microwave furnace only, whereas, interaction with a single-mode furnace showed plasma generation. Phase formation was observed by X-ray diffraction. Microwave dielectric characteristics such as dielectric constant (epsilon'), quality factor (Q x f) and temperature coefficient of resonant frequency (tauf) of microwave sintered samples were measured using a vector network analyzer and compared with conventional sintered ones. Microstructure of all the conventional and microwave sintered samples was observed using high resolution scanning electron microscope. Although epsilon' and tauf of the conventional and microwave sintered samples are found to be comparable, the quality factor (the vital characteristic of dielectric resonators) of microwave sintered samples are observed to be much lower than those obtained by conventional sintering. The difference in these values is discussed with respect to the grain size.

  9. Study on the interaction between diphenhydramine and erythrosin by absorption, fluorescence and resonance Rayleigh scattering spectra

    Institute of Scientific and Technical Information of China (English)

    TANG XiaoLing; LIU ZhongFang; LIU ShaoPu; HU XiaoLi

    2007-01-01

    In pH 4.5 Britton-Robinson (BR) buffer solution, erythrosin (ET) can react with diphenhydramine (DP) to form a 1:1 ion-association complex, which not only results in the change of the absorption spectra, but also results in the great enhancement of resonance Rayleigh scattering (RRS) and the quenching of fluorescence. Furthermore, a new RRS spectrum will appear, and the maximum RRS wavelength was located at about 580 nm.In this work, the spectral characteristics of the absorption, fluorescence and RRS, the optimum conditions of the reaction and the properties of an analytical chemistry were investigated. A sensitive, simple and new method for the determination of DP by using erythrosin as a probe has been developed. The detection limits for DP were 0.0020 μg/mL for RRS method, 0.088 μg/mL for absorption method and 0.094 μg/mL for fluorophotometry. There was a linear relationship between the absorbance, RRS and fluorescence intensities and the drug concentration in the range of 0.0067-2.0, 0.29-6.4 and 0.31-3.2 μg/mL, respectively. The effects of the interaction of diphenhydramine and erythrosin on the absorption, fluorescence and resonance Rayleigh scattering spectra were discussed. In light polarization experiment, the polarization of RRS at maximum wavelength was measured to be P = 0.9779, and it revealed that the RRS spectrum of DP-ET complex consists mostly of resonance scattering and few resonance fluorescence. In this study, enthalpy of formation and mean polarizability were calculated by AM1 quantum chemistry method. In addition, the reaction mechanism and the reasons for the enhancement of scattering spectra and the energy transfer between absorption, fluorescence and RRS were discussed.

  10. Secular resonances between bodies on close orbits: a case study of the Himalia prograde group of jovian irregular satellites

    CERN Document Server

    Li, Daohai

    2016-01-01

    The gravitational interaction between two objects on similar orbits can effect noticeable changes in the orbital evolution even if the ratio of their masses to that of the central body is vanishingly small. Christou (2005) observed an occasional resonant lock in the differential node $\\Delta \\Omega$ between two members in the Himalia irregular satellite group of Jupiter in the $N$-body simulations (corresponding mass ratio $\\sim 10^{-9}$). Using a semianalytical approach, we have reproduced this phenomenon. We also demonstrate the existence of two additional types of resonance, involving angle differences $\\Delta\\omega$ and $\\Delta (\\Omega+\\varpi)$ between two group members. These resonances cause secular oscillations in eccentricity and/or inclination on timescales $\\sim$ 1 Myr. We locate these resonances in $(a,e,i)$ space and analyse their topological structure. In subsequent $N$-body simulations, we confirm these three resonances and find a fourth one involving $\\Delta \\varpi$. In addition, we study the o...

  11. Sectional model test study on vortex-excited resonance of vehicle-bridge system of Shanghai Bridge over Yangtse River

    Institute of Scientific and Technical Information of China (English)

    Li ZHOU; Yaojun GE

    2009-01-01

    It is necessary to study how vehicles influence the vortex-excited resonance of vehicle-bridge systems,because lock-in wind speed is low and vortex-excited resonance is sensitive to any change in the main girder sections. Based on the Shanghai Bridge over the Yangtse River, the vortex-excited resonance of a 1:60 scale sectional model was tested in a TJ-lwind tunnel, with or without vehicles at the attack angle of 0°, + 3 and -3°,respectively. The conversion relationships between the resonant amplitudes of the sectional model and that of the prototype bridge were also established by mode shape correction. The result indicates that: 1) for the bridge with vehicles, the vertical vortex-excited resonance is accom-panied by torsion vibration with the same frequency, and vice versa, 2) the amplitude of vortex-excited resonance of the bridge with vehicles is much larger than that of the bridge without vehicles, and 3) the lock-in wind speed of the vortex-excited resonance becomes smaller due to the disturbance of vehicles. It is obvious that vehicles bring about changes in the aerodynamic shape of the main girder.Therefore, the influence of vehicles on vortex-excited resonance performance of vehicle-bridge systems, in terms of both amplitude and mode, should not be ignored.

  12. Secular resonances between bodies on close orbits: a case study of the Himalia prograde group of jovian irregular satellites

    Science.gov (United States)

    Li, Daohai; Christou, Apostolos A.

    2016-06-01

    The gravitational interaction between two objects on similar orbits can effect noticeable changes in the orbital evolution even if the ratio of their masses to that of the central body is vanishingly small. Christou (Icarus 174:215-229, 2005) observed an occasional resonant lock in the differential node Δ Ω between two members in the Himalia irregular satellite group of Jupiter in the N-body simulations (corresponding mass ratio ˜ 10^{-9}). Using a semianalytical approach, we have reproduced this phenomenon. We also demonstrate the existence of two additional types of resonance, involving angle differences Δ ω and Δ (Ω +π) between two group members. These resonances cause secular oscillations in eccentricity and/or inclination on timescales ˜ 1 Myr. We locate these resonances in ( a, e, i) space and analyse their topological structure. In subsequent N-body simulations, we confirm these three resonances and find a fourth one involving Δ π. In addition, we study the occurrence rates and the stability of the four resonances from a statistical perspective by integrating 1000 test particles for 100 Myr. We find ˜ 10 to 30 librators for each of the resonances. Particularly, the nodal resonance found by Christou is the most stable: 2 particles are observed to stay in libration for the entire integration.

  13. Bipartite Medial Cuneiform: Case Report and Retrospective Review of 1000 Magnetic Resonance (MR Imaging Studies

    Directory of Open Access Journals (Sweden)

    Geraldine H. Chang

    2014-01-01

    Full Text Available Objective. To present a unique case report of a Lisfranc fracture in a patient with a bipartite medial cuneiform and to evaluate the prevalence of the bipartite medial cuneiform in a retrospective review of 1000 magnetic resonance (MR imaging studies of the foot. Materials and Methods. Case report followed by a retrospective review of 1000 MR imaging studies of the foot for the presence or absence of a bipartite medial cuneiform. Results. The incidence of the bipartite medial cuneiform is 0.1%. Conclusion. A bipartite medial cuneiform is a rare finding but one with both clinical and surgical implications.

  14. Numerical simulation study on spin resonant depolarization due to spin-orbit coupling

    Institute of Scientific and Technical Information of China (English)

    Lan Jie-Qin; Xu Hong-Liang

    2012-01-01

    The spin polarization phenomenon in lepton circular accelerators had been known for many years.It provides a new approach for physicists to study the spin feature of fundamental particles and the dynamics of spin-orbit coupling,such as spin resonances.We use numerical simulation to study the features of spin under the modulation of orbital motion in an electron storage ring.The various cases of depolarization due to spin-orbit coupling through an emitting photon and misalignment of magnets in the ring are discussed.

  15. Pineal cyst: study with magnetic resonance. Quistes pineales simples: estudio con resonancia magnetica

    Energy Technology Data Exchange (ETDEWEB)

    Paniagua, J.C.; Aleixandre, A.; Esteban, M.J.; Marti-Bomati, L.; Poyatos, C. (Hospital Universitario La Fe, Valencia (Spain))

    1992-01-01

    The use of magnetic resonance (MR) as a diagnostic technique in central nervous system pathology has made possible the detection of structures that are hard to view with other diagnostic methods. In 21 patients in whom the existence of pineal cyst was detected by chance, we describe the study technique employed and present the MR characterization. In the absence of specific clinical symptoms and sings, the differential diagnosis of this pathology, with respect to other neoplastic formations located in the pineal gland, is based on its typical location behind the third ventricle, its size, which does not vary in the different serial studies, and its signal intensity. (author)

  16. Studying 750 GeV di-photon resonance at photon–photon collider

    Directory of Open Access Journals (Sweden)

    Hayato Ito

    2016-05-01

    Full Text Available Motivated by the recent LHC discovery of the di-photon excess at the invariant mass of ∼750 GeV, we study the prospect of investigating the scalar resonance at a future photon–photon collider. We show that, if the di-photon excess observed at the LHC is due to a new scalar boson coupled to the standard-model gauge bosons, such a scalar boson can be observed and studied at the photon–photon collider with the center-of-mass energy of ∼1 TeV in large fraction of parameter space.

  17. Radioligands for the study of brain 5-HT{sub 1A} receptors in vivo-development of some new analogues of way

    Energy Technology Data Exchange (ETDEWEB)

    Pike, Victor W.; Halldin, Christer; Wikstroem, Haakan; Marchais, Sandrine; McCarron, Julie A.; Sandell, Johan; Nowicki, Bartek; Swahn, Carl-Gunnar; Osman, Safiye; Hume, Susan P.; Constantinou, Maria; Andree, Bengt; Farde, Lars

    2000-07-01

    [Carbonyl-{sup 11}C]WAY-100635 (WAY) has proved to be a very useful radioligand for the imaging of brain 5-HT{sub 1A} receptors in human brain in vivo with positron emission tomography (PET). WAY is now being applied widely for clinical research and drug development. However, WAY is rapidly cleared from plasma and is also rapidly metabolised. A comparable radioligand, with a higher and more sustained delivery to brain, is desirable since these properties might lead to better biomathematical modelling of acquired PET data. There are also needs for other types of 5-HT{sub 1A} receptor radioligands, for example, ligands sensitive to elevated serotonin levels, ligands labelled with longer-lived fluorine-18 for distribution to 'satellite' PET centres, and ligands labelled with iodine-123 for single photon emission computerised tomography (SPECT) imaging. Here we describe our progress toward these aims through the exploration of WAY analogues, including the development of [carbonyl-{sup 11}C]desmethyl-WAY (DWAY) as a promising, more brain-penetrant radioligand for PET imaging of human 5-HT{sub 1A} receptors, and (pyridinyl-6-halo)-analogues as promising leads for the development of radiohalogenated ligands.

  18. 新皮啡肽Ⅰ类似物构效关系的研究%Studies on the Structure-activity Relation of Deltorphin I Analogues

    Institute of Scientific and Technical Information of China (English)

    嘉庆; 刘萍

    2001-01-01

    Endogenous opioid deltorphin I (DEL I) and its analogues(progressive, stepwise repositioning of Asp from 5 to 7) were synthesized by using solid phase method. It was found that the order (from strong to weak) of analgesic effect and immune activity is Asp5(Asp6),Asp4(Asp7) and Asp4, Asp5, Asp6, Asp5, respectively. This result suggested that the position's alteration of hydrophobic amino-acid residues at C-terminal of DEL I analogues strongly influences biological activities and three dimentional structure of the whole molecule.%用固相法合成了内源性类阿片肽新皮啡肽I(DELI)及其3个类似物(Asp从5位到7位).实验发现DELI及其类似物的镇痛和免疫活性次序(由大到小)分别是Asp5(Asp6)、Asp4(Asp7)和Asp4、Asp7、Asp6、Asp5,这说明DELI类似物序列中碳端疏水氨基酸残基的位置的改变对生物活性和整个分子的三维结构影响很大.

  19. All-dielectric metasurface analogue of electromagnetically induced transparency.

    Science.gov (United States)

    Yang, Yuanmu; Kravchenko, Ivan I; Briggs, Dayrl P; Valentine, Jason

    2014-12-16

    Metasurface analogues of electromagnetically induced transparency (EIT) have been a focus of the nanophotonics field in recent years, due to their ability to produce high-quality factor (Q-factor) resonances. Such resonances are expected to be useful for applications such as low-loss slow-light devices and highly sensitive optical sensors. However, ohmic losses limit the achievable Q-factors in conventional plasmonic EIT metasurfaces to values dielectric silicon-based metasurfaces. Due to extremely low absorption loss and coherent interaction of neighbouring meta-atoms, a Q-factor of 483 is observed, leading to a refractive index sensor with a figure-of-merit of 103. Furthermore, we show that the dielectric metasurfaces can be engineered to confine the optical field in either the silicon resonator or the environment, allowing one to tailor light-matter interaction at the nanoscale.

  20. A comparative autoradiography study in post mortem whole hemisphere human brain slices taken from Alzheimer patients and age-matched controls using two radiolabelled DAA1106 analogues with high affinity to the peripheral benzodiazepine receptor (PBR) system.

    Science.gov (United States)

    Gulyás, Balázs; Makkai, Boglárka; Kása, Péter; Gulya, Károly; Bakota, Lidia; Várszegi, Szilvia; Beliczai, Zsuzsa; Andersson, Jan; Csiba, László; Thiele, Andrea; Dyrks, Thomas; Suhara, Tetsua; Suzuki, Kazutoshi; Higuchi, Makato; Halldin, Christer

    2009-01-01

    The binding of two radiolabelled analogues (N-(5-[125I]Iodo-2-phenoxyphenyl)-N-(2,5-dimethoxybenzyl)acetamide ([125I]desfluoro-DAA1106) and N-(5-[125I]Fluoro-2-phenoxyphenyl)-N-(2-[125I]Iodo-5-methoxybenzyl)acetamide ([125I]desmethoxy-DAA1106) of the peripheral benzodiazepine receptor (PBR) (or TSPO, 18kDa translocator protein) ligand DAA1106 was examined by in vitro autoradiography on human post mortem whole hemisphere brain slices obtained from Alzheimer's disease (AD) patients and age-matched controls. Both [(125)I]desfluoro-IDAA1106 and [(125)I]desmethoxy-IDAA1106 were effectively binding to various brain structures. The binding could be blocked by the unlabelled ligand as well as by other PBR specific ligands. With both radiolabelled compounds, the binding showed regional inhomogeneity and the specific binding values proved to be the highest in the hippocampus, temporal and parietal cortex, the basal ganglia and thalamus in the AD brains. Compared with age-matched control brains, specific binding in several brain structures (temporal and parietal lobes, thalamus and white matter) in Alzheimer brains was significantly higher, indicating that the radioligands can effectively label-activated microglia and the up-regulated PBR/TSPO system in AD. Complementary immunohistochemical studies demonstrated reactive microglia activation in the AD brain tissue and indicated that increased ligand binding coincides with increased regional microglia activation due to neuroinflammation. These investigations yield further support to the PBR/TSPO binding capacity of DAA1106 in human brain tissue, demonstrate the effective usefulness of its radio-iodinated analogues as imaging biomarkers in post mortem human studies, and indicate that its radiolabelled analogues, labelled with short half-time bioisotopes, can serve as prospective in vivo imaging biomarkers of activated microglia and the up-regulated PBR/TSPO system in the human brain.

  1. Measuring Mental Imagery with Visual Analogue Scales.

    Science.gov (United States)

    Quilter, Shawn M.; Band, Jennie P.; Miller, Gary M.

    1999-01-01

    Investigates some of the psychometric characteristics of the results from visual-analogue scales used to measure mental imagery. Reports that the scores from visual-analogue scales are positively related to scores from longer pencil-and-paper measures of mental imagery. Implications and limitations for the use of visual-analogue scales to measure…

  2. Parametric Study of Cylindrical Dielectric Resonator Antenna (CDRA Feeder with Symmetric Parabolic Reflector

    Directory of Open Access Journals (Sweden)

    S.M. Ali

    2015-06-01

    Full Text Available In this study a parabolic reflector antenna is designed and fabricated for IEEE 802.11a WLAN application. Initially, a single element circular tuning slot coupled Cylindrical Dielectric Resonator Antenna (CDRA feeder is designed and fabricated for a symmetric parabolic reflector. Subsequently, the designed feeder is integrated at the focal point of the parabolic reflector to provide unidirectional radiation pattern with improved gain and sidelobe levels. The measured fractional impedance bandwidth achieved for the proposed antenna is 1.8% for S11<-10 dB from 5.32 to 5.52 GHz. A radiation pattern with broadside radiation and low back radiation has been obtained. A good measurement gain of approximately 13 dB is achieved over the bandwidth by placing CDRA feeder at the focal point of the parabolic reflector. In addition, a comprehensive parametric study has been conducted to realize the effect of slot size and position on the resonance frequency of the designed feeder. Furthermore, a parametric study of various reflector parameters has also been performed to study the effect of size, depth and focal point of the parabolic reflector on gain of the antenna. Important design factors have been identified from the parametric study of the antenna. The experimental and measured results show that the designed antenna is suitable for IEEE WLAN 802.11a wireless application.

  3. Incidental findings are frequent in young healthy individuals undergoing magnetic resonance imaging in brain research imaging studies

    DEFF Research Database (Denmark)

    Hartwigsen, Gesa; Siebner, Hartwig R; Deuschl, Günther;

    2010-01-01

    There is an ongoing debate about how to handle incidental findings (IF) detected in healthy individuals who participate in research-driven magnetic resonance imaging (MRI) studies. There are currently no established guidelines regarding their management.......There is an ongoing debate about how to handle incidental findings (IF) detected in healthy individuals who participate in research-driven magnetic resonance imaging (MRI) studies. There are currently no established guidelines regarding their management....

  4. Development of techniques in magnetic resonance and structural studies of the prion protein

    Energy Technology Data Exchange (ETDEWEB)

    Bitter, Hans-Marcus L. [Univ. of California, Berkeley, CA (United States)

    2000-07-01

    Magnetic resonance is the most powerful analytical tool used by chemists today. Its applications range from determining structures of large biomolecules to imaging of human brains. Nevertheless, magnetic resonance remains a relatively young field, in which many techniques are currently being developed that have broad applications. In this dissertation, two new techniques are presented, one that enables the determination of torsion angles in solid-state peptides and proteins, and another that involves imaging of heterogenous materials at ultra-low magnetic fields. In addition, structural studies of the prion protein via solid-state NMR are described. More specifically, work is presented in which the dependence of chemical shifts on local molecular structure is used to predict chemical shift tensors in solid-state peptides with theoretical ab initio surfaces. These predictions are then used to determine the backbone dihedral angles in peptides. This method utilizes the theoretical chemicalshift tensors and experimentally determined chemical-shift anisotropies (CSAs) to predict the backbone and side chain torsion angles in alanine, leucine, and valine residues. Additionally, structural studies of prion protein fragments are described in which conformationally-dependent chemical-shift measurements were made to gain insight into the structural differences between the various conformational states of the prion protein. These studies are of biological and pathological interest since conformational changes in the prion protein are believed to cause prion diseases. Finally, an ultra-low field magnetic resonance imaging technique is described that enables imaging and characterization of heterogeneous and porous media. The notion of imaging gases at ultra-low fields would appear to be very difficult due to the prohibitively low polarization and spin densities as well as the low sensitivities of conventional Faraday coil detectors. However, Chapter 5 describes how gas imaging

  5. Development of techniques in magnetic resonance and structural studies of the prion protein

    Energy Technology Data Exchange (ETDEWEB)

    Bitter, Hans-Marcus L.

    2000-07-01

    Magnetic resonance is the most powerful analytical tool used by chemists today. Its applications range from determining structures of large biomolecules to imaging of human brains. Nevertheless, magnetic resonance remains a relatively young field, in which many techniques are currently being developed that have broad applications. In this dissertation, two new techniques are presented, one that enables the determination of torsion angles in solid-state peptides and proteins, and another that involves imaging of heterogenous materials at ultra-low magnetic fields. In addition, structural studies of the prion protein via solid-state NMR are described. More specifically, work is presented in which the dependence of chemical shifts on local molecular structure is used to predict chemical shift tensors in solid-state peptides with theoretical ab initio surfaces. These predictions are then used to determine the backbone dihedral angles in peptides. This method utilizes the theoretical chemicalshift tensors and experimentally determined chemical-shift anisotropies (CSAs) to predict the backbone and side chain torsion angles in alanine, leucine, and valine residues. Additionally, structural studies of prion protein fragments are described in which conformationally-dependent chemical-shift measurements were made to gain insight into the structural differences between the various conformational states of the prion protein. These studies are of biological and pathological interest since conformational changes in the prion protein are believed to cause prion diseases. Finally, an ultra-low field magnetic resonance imaging technique is described that enables imaging and characterization of heterogeneous and porous media. The notion of imaging gases at ultra-low fields would appear to be very difficult due to the prohibitively low polarization and spin densities as well as the low sensitivities of conventional Faraday coil detectors. However, Chapter 5 describes how gas imaging

  6. Evaluation Of Microdosing Strategies For Studies In Preclinical Drug Development: Demonstration Of Linear Pharmacokinetics In Dogs Of A Nucleoside Analogue Over A 50-Fold Dose Range

    Energy Technology Data Exchange (ETDEWEB)

    Sandhu, P; Vogel, J S; Rose, M J; Ubick, E A; Brunner, J E; Wallace, M A; Adelsberger, J K; Baker, M P; Henderson, P T; Pearson, P G; Baillie, T A

    2004-04-22

    (Stafford et al., 1984; Vogel et al., 1990; Smith et al., 1999) to its use as a bioanalytical tool for nutritional research (Buchholz et al., 1999; Deuker et al., 2000; Weaver and Liebman, 2002). Biomedical applications of AMS and its use in the arena of pharmaceutical research also have been detailed in review articles (Barker and Garner, 1999; Garner, 2000; Turteltaub and Vogel, 2000). To date, most studies on the metabolism and disposition of xenobiotics by AMS have focused on how carcinogens bind to DNA and proteins to form adducts (Turteltaub et al., 1990, 1997; Frantz et al., 1995; Dingley et al., 1999; Li et al., 2003). Its application to the field of pharmaceutical sciences has been limited to a few studies (Kaye et al., 1997; Young et al., 2001; Garner et al., 2002). However, the pharmaceutical industry is becoming increasingly aware of the potential benefits that may accrue from the ultra high sensitivity afforded by AMS in terms of evaluating the pharmacokinetics of lead drug candidates in early development. Specifically, AMS allows administration of sub-pharmacological doses (microdoses) of carbon-14 or tritium-labeled investigational drugs to animals or humans at radiologically insignificant levels with the goal of obtaining preliminary information regarding the absorption, distribution, metabolism, and excretion of test compounds (Turteltaub and Vogel, 2000). An unresolved issue, however, is whether the pharmacokinetics determined following a microdose are representative of those following a conventional (pharmacological) dose (Lappin and Garner, 2003). This paper examines the linearity of kinetics of an antiviral nucleoside analogue, Compound A, across sub-pharmacological and pharmacological dose ranges in the dog prior to initiation of a human microdose study. The specific objectives of this study, therefore, were (1) to assess the pharmacokinetics of Compound A in dogs by a conventional dosing approach utilizing LC-MS/MS for sample analysis, (2) to assess

  7. Study on the Processing Method for Resonance Self-shielding Calculations

    Institute of Scientific and Technical Information of China (English)

    2011-01-01

    We investigate a new approach for resonance self-shielding calculations, based on a straightforward subgroup method, used in association with characteristics method. Subgroup method is actually the subdivision of cross section range for resonance energy range.

  8. Anatomical study of the confluence of the sinuses with contrast-enhanced magnetic resonance venography

    Energy Technology Data Exchange (ETDEWEB)

    Kobayashi, Keiko; Matsui, Osamu; Ueda, Fumiaki [Kanazawa University School of Medicine, Department of Radiology, Kanazawa, Ishikawa (Japan); Suzuki, Masayuki [Kanazawa University School of Health Science, Department of Radiological Technology, Kanazawa, Ishikawa (Japan)

    2006-05-15

    It is important that each dural sinus can be recognized during brain surgery and that the venous route can be used for interventional procedures. In this study, the anatomical features and patterns of the confluence of the sinuses were analyzed. The technique of contrast-enhanced three-dimensional magnetic resonance venography was used in 549 patients. There were many anatomical variations in the confluence of the sinuses. Most cases had wide communication between the right and left transverse sinuses. Careful examination of the confluence of the sinuses is essential for the preoperative evaluation of posterior cranial fossa lesions and interventional procedures using the venous route. (orig.)

  9. Investigating the emotional response to room acoustics: A functional magnetic resonance imaging study.

    Science.gov (United States)

    Lawless, M S; Vigeant, M C

    2015-10-01

    While previous research has demonstrated the powerful influence of pleasant and unpleasant music on emotions, the present study utilizes functional magnetic resonance imaging (fMRI) to assess the positive and negative emotional responses as demonstrated in the brain when listening to music convolved with varying room acoustic conditions. During fMRI scans, subjects rated auralizations created in a simulated concert hall with varying reverberation times. The analysis detected activations in the dorsal striatum, a region associated with anticipation of reward, for two individuals for the highest rated stimulus, though no activations were found for regions associated with negative emotions in any subject.

  10. Study of dielectric films in superconducting resonators using pulse echo techniques

    Science.gov (United States)

    Ramanayaka, A. N.; Sarabi, B.; Stoutimore, M. J. A.; Osborn, K. D.

    2013-03-01

    Energy absorption by two-level systems (TLS) in amorphous dielectric films is a source of decoherence in superconducting qubits, but their microscopic nature is unknown in specific films. To reveal their nature it is helpful to study their dynamics, which we do by embedding them in the parallel-plate capacitor of a linear resonator that is coupled to probing fields through a coplanar waveguide. Measurements are performed at 4-8 GHz and 25-200 mK on amorphous silicon nitride films. We will report on progress to extract the coherence times, field coupling, and the corresponding distributions of these tunneling states.

  11. Neural basis of Chinese phonological processing under picture stimulus A functional magnetic resonance imaging study

    Institute of Scientific and Technical Information of China (English)

    Junfei Liu; Shiwen Feng; Wei Song; Liang Yu; Haijiang Cui; Yiming Yang

    2011-01-01

    Studies concerning phonological processing mainly use written stimuli. Functional magnetic resonance imaging was used to investigate the brain regions related to the phonological processing under the picture stimulus in the rhyme task of Chinese language. Results of the test in 13 healthy college students whose native language is Chinese showed the extensive activation in the frontal lobe, parietal lobe and the occipitotemporal cortex, including the inferior frontal gyrus, middle frontal gyrus, supramarginal gyrus and medial occipitotemporal gyrus under the picture stimuli. Moreover, phonological processing induced activation in the superior temporal gyrus (BA 22) under the picture stimuli, but activation was not found in the middle temporal gyrus.

  12. Study of free radicals in gamma irradiated cellulose of cultural heritage materials using Electron Paramagnetic Resonance

    Science.gov (United States)

    Kodama, Yasko; Rodrigues, Orlando, Jr.; Garcia, Rafael Henrique Lazzari; Santos, Paulo de Souza; Vasquez, Pablo A. S.

    2016-07-01

    Main subject of this article was to study room temperature stable radicals in Co-60 gamma irradiated contemporary paper using Electron Paramagnetic Resonance spectrometer (EPR). XRD was used to study the effect of ionizing radiation on the morphology of book paper. SEM images presented regions with cellulose fibers and regions with particles agglomeration on the cellulose fibers. Those agglomerations were rich in calcium, observed by EDS. XRD analysis confirmed presence of calcium carbonate diffraction peaks. The main objective of this study was to propose a method using conventional kinetics chemical reactions for the observed radical formed by ionizing radiation. Therefore, further analyses were made to study the half-life and the kinetics of the free radical created. This method can be suitably applied to study radicals on cultural heritage objects.

  13. Synthesis and properties of ApA analogues with shortened phosphonate internucleotide linkage.

    Science.gov (United States)

    Králíková, Sárka; Buděšínský, Miloš; Barvík, Ivan; Masojídková, Milena; Točík, Zdeněk; Rosenberg, Ivan

    2011-01-01

    A complete series of the 2 '-5 ' and 3 '-5 ' regioisomeric types of r(ApA) and 2 '-d(ApA) analogues with the α-hydroxy-phosphonate C3 '-O-P-CH(OH)-C4 ″ internucleotide linkage, isopolar but non-isosteric with the phosphodiester one, were synthesized and their hybridization properties with polyU studied. Due to the chirality on the 5 '-carbon atom of the modified internucleotide linkage bearing phosphorus and hydroxy moieties, each regioisomeric type of ApA dimer is split into epimeric pairs. To examine the role of the 5 '-hydroxyl of the α-hydroxy-phosphonate moiety during hybridization, the appropriate r(ApA) analogues with 3 '(2 ')-O-P-CH(2)-C4 ″ linkage lacking the 5 '-hydroxyl were synthesized. Nuclear magnetic resonance (NMR) spectroscopy study on the conformation of the modified sugar-phosphate backbone, along with the hybridization measurements, revealed remarkable differences in the stability of complexes with polyU, depending on the 5 '-carbon atom configuration. Potential usefulness of the α-hydroxy-phosphonate linkage in modified oligoribonucleotides is discussed.

  14. Studying thin film damping in a micro-beam resonator based on non-classical theories

    Science.gov (United States)

    Ghanbari, Mina; Hossainpour, Siamak; Rezazadeh, Ghader

    2016-06-01

    In this paper, a mathematical model is presented for studying thin film damping of the surrounding fluid in an in-plane oscillating micro-beam resonator. The proposed model for this study is made up of a clamped-clamped micro-beam bound between two fixed layers. The micro-gap between the micro-beam and fixed layers is filled with air. As classical theories are not properly capable of predicting the size dependence behaviors of the micro-beam, and also behavior of micro-scale fluid media, hence in the presented model, equation of motion governing longitudinal displacement of the micro-beam has been extracted based on non-local elasticity theory. Furthermore, the fluid field has been modeled based on micro-polar theory. These coupled equations have been simplified using Newton-Laplace and continuity equations. After transforming to non-dimensional form and linearizing, the equations have been discretized and solved simultaneously using a Galerkin-based reduced order model. Considering slip boundary conditions and applying a complex frequency approach, the equivalent damping ratio and quality factor of the micro-beam resonator have been obtained. The obtained values for the quality factor have been compared to those based on classical theories. We have shown that applying non-classical theories underestimate the values of the quality factor obtained based on classical theories. The effects of geometrical parameters of the micro-beam and micro-scale fluid field on the quality factor of the resonator have also been investigated.

  15. Study of selective heating at ion cyclotron resonance for the plasma separation process

    Science.gov (United States)

    Compant La Fontaine, A.; Pashkovsky, V. G.

    1995-12-01

    The plasma separation process by ion cyclotron resonance heating (ICRH) is studied both theoretically and experimentally on two devices: the first one called ERIC (Ion Cyclotron Resonance Experiment) at Saclay (France) [P. Louvet, Proceedings of the 2nd Workshop on Separation Phenomena in Liquids and Gases, Versailles, France, 1989, edited by P. Louvet, P. Noe, and Soubbaramayer (Centre d'Etudes Nucléaires de Saclay and Cité Scientifique Parcs et Technopoles, Ile de France Sud, France, 1989), Vol. 1, p. 5] and the other one named SIRENA at the Kurchatov Institute, Moscow, Russia [A. I. Karchevskii et al., Plasma Phys. Rep. 19, 214 (1993)]. The radio frequency (RF) transversal magnetic field is measured by a magnetic probe both in plasma and vacuum and its Fourier spectrum versus the axial wave number kz is obtained. These results are in agreement with the electromagnetic (EM) field calculation model based on resolution of Maxwell equations by a time-harmonic scheme studied here. Various axial boundary conditions models used to compute the EM field are considered. The RF magnetic field is weakly influenced by the plasma while the electric field components are strongly disturbed due to space-charge effects. In the plasma the transversal electric field is enhanced and the kz spectrum is narrower than in vacuum. The calculation of the resonant isotope heating is made by the Runge-Kutta method. The influence of ion-ion collisions, inhomogeneity of the static magnetic field B0, and the RF transversal magnetic field component on the ion acceleration is examined. These results are successfully compared with experiments of a minor isotope 44Ca heating measurements, made with an energy analyzer.

  16. Study of selective heating at ion cyclotron resonance for the plasma separation process

    Energy Technology Data Exchange (ETDEWEB)

    Compant La Fontaine, A. [Direction du Cycle du Combustible/Departement des Procedes d` Enrichissement, Service de Physique, d` Experimentation et d` Analyse, Commissariat a l` Energie Atomique, Centre d` Etudes de Saclay, 91191 Gif-sur-Yvette Cedex (France); Pashkovsky, V.G. [Molecular Physics Institute, RRC Kurchatov Institute 123182, Moscow (Russian Federation)

    1995-12-01

    The plasma separation process by ion cyclotron resonance heating (ICRH) is studied both theoretically and experimentally on two devices: the first one called ERIC (Ion Cyclotron Resonance Experiment) at Saclay (France) [P. Louvet, {ital Proceedings} {ital of} {ital the} 2{ital nd} {ital Workshop} {ital on} {ital Separation} {ital Phenomena} {ital in} {ital Liquids} {ital and} {ital Gases}, Versailles, France, 1989, edited by P. Louvet, P. Noe, and Soubbaramayer (Centre d`Etudes Nucleaires de Saclay and Cite Scientifique Parcs et Technopoles, Ile de France Sud, France, 1989), Vol. 1, p. 5] and the other one named SIRENA at the Kurchatov Institute, Moscow, Russia [A. I. Karchevskii {ital et} {ital al}., Plasma Phys. Rep. {bold 19}, 214 (1993)]. The radio frequency (RF) transversal magnetic field is measured by a magnetic probe both in plasma and vacuum and its Fourier spectrum versus the axial wave number {ital k}{sub {ital z}} is obtained. These results are in agreement with the electromagnetic (EM) field calculation model based on resolution of Maxwell equations by a time-harmonic scheme studied here. Various axial boundary conditions models used to compute the EM field are considered. The RF magnetic field is weakly influenced by the plasma while the electric field components are strongly disturbed due to space-charge effects. In the plasma the transversal electric field is enhanced and the {ital k}{sub {ital z}} spectrum is narrower than in vacuum. The calculation of the resonant isotope heating is made by the Runge--Kutta method. The influence of ion--ion collisions, inhomogeneity of the static magnetic field {ital B}{sub 0}, and the RF transversal magnetic field component on the ion acceleration is examined. These results are successfully compared with experiments of a minor isotope {sup 44}Ca heating measurements, made with an energy analyzer. {copyright} {ital 1995} {ital American} {ital Institute} {ital of} {ital Physics}.

  17. Studying thin film damping in a micro-beam resonator based on non-classical theories

    Institute of Scientific and Technical Information of China (English)

    Mina Ghanbari; Siamak Hossainpour; Ghader Rezazadeh

    2016-01-01

    In this paper, a mathematical model is presented for studying thin film damping of the surrounding fluid in an in-plane oscillating micro-beam resonator. The proposed model for this study is made up of a clamped-clamped micro-beam bound between two fixed layers. The micro-gap between the micro-beam and fixed layers is filled with air. As classical theories are not properly capable of pre-dicting the size dependence behaviors of the micro-beam, and also behavior of micro-scale fluid media, hence in the presented model, equation of motion governing longitudinal displacement of the micro-beam has been extracted based on non-local elasticity theory. Furthermore, the fluid field has been modeled based on micro-polar theory. These coupled equations have been simplified using Newton-Laplace and continuity equations. After transforming to non-dimensional form and linearizing, the equations have been discretized and solved simultaneously using a Galerkin-based reduced order model. Considering slip boundary conditions and applying a complex frequency approach, the equivalent damping ratio and quality factor of the micro-beam resonator have been obtained. The obtained values for the quality factor have been compared to those based on classical theories. We have shown that applying non-classical theories underestimate the values of the quality factor obtained based on classical theo-ries. The effects of geometrical parameters of the micro-beam and micro-scale fluid field on the quality factor of the res-onator have also been investigated.

  18. Synthesis and in vitro evaluation of novel triazine analogues as anticancer agents and their interaction studies with bovine serum albumin.

    Science.gov (United States)

    Singla, Prinka; Luxami, Vijay; Paul, Kamaldeep

    2016-07-19

    A novel series of triazine-benzimidazole analogs has been designed and synthesized for their in vitro anticancer activities. Four compounds (6, 16, 17 and 20) were identified as highly potent anticancer agents against 60 human cancer cell lines with GI50 in the nanomolar range. To improve the drug applications toward cancer cells, there is a need to couple these compounds to some carrier macromolecules. Following this approach, the interaction between triazine-benzimidazole analogues and bovine serum albumin (BSA) has been investigated with UV-Visible and fluorescence spectroscopic methods under physiological conditions. The observed fluorescence quenching indicates that these compounds could efficiently bind with BSA and be transported to the target site.

  19. A comparison of a patient-rated visual analogue scale with the Liebowitz Social Anxiety Scale for social anxiety disorder: A cross-sectional study

    OpenAIRE

    興津, 裕美

    2014-01-01

    博士(医学) 乙第2814号, 著者名:Hiromi Okitsu・Jitsuki Sawamura・Katsuji Nishimura・Yasuto Sato・Jun Ishigooka,タイトル:A comparison of a patient-rated visual analogue scale with the Liebowitz Social Anxiety Scale for social anxiety disorder: A cross-sectional study,掲載誌:Open Journal of Psychiatry (2161-7325),巻・頁・年:4巻1号 p.68~74 (2014),著作権関連情報:Copyright © 2014 by authors and Scientific Research Publishing Inc.,DOI:10.4236/ojpsych.2014.41010...

  20. The Greenland analogue project. Yearly report 2010

    Energy Technology Data Exchange (ETDEWEB)

    Harper, J.; Brinkerhoff, D.; Johnson, J. [University of Montana, Missoula (United States); Ruskeeniemi, T.; Engstroem, J.; Kukkonen, I. [Geological Survey of Finland (Finland)] [and others

    2012-04-15

    A four-year field and modelling study of the Greenland ice sheet and subsurface conditions, Greenland Analogue Project (GAP), has been initiated collaboratively by SKB, Posiva and NWMO to advance the understanding of processes associated with glaciation and their impact on the long-term performance of a deep geological repository. The study site encompasses a land terminus portion of the Greenland ice sheet, east of Kangerlussuaq, and is in many ways considered to be an appropriate analogue of the conditions that are expected to prevail in much of Canada and Fennoscandia during future glacial cycles. The project begins in 2009 and is scheduled for completion in 2012. Our current understanding of the hydrological, hydrogeological and hydrogeochemical processes associated with cold climate conditions and glacial cycles, and their impact on the long-term performance of deep geological repositories for spent nuclear fuel, will be significantly improved by studying a modern analogue. The GAP will conduct the first in situ investigations of some of the parameters and processes needed to achieve a better understanding of how an ice sheet may impact a deep repository, and will provide measurements, observations and data that may significantly improve our safety assessments and risk analyses of glaciation scenarios. This report was produced by the GAP team members and presents an overview of the activities within the GAP during the interval January 1 to December 31, 2010, as well as research results obtained during this time frame. Research for the GAP is ongoing, and additional results related to the data presented here may become available in the future and will be presented in subsequent annual reports. (orig.)

  1. Incorporation of tryptophan analogues into the lantibiotic nisin.

    Science.gov (United States)

    Zhou, Liang; Shao, Jinfeng; Li, Qian; van Heel, Auke J; de Vries, Marcel P; Broos, Jaap; Kuipers, Oscar P

    2016-05-01

    Lantibiotics are posttranslationally modified peptides with efficient inhibitory activity against various Gram-positive bacteria. In addition to the original modifications, incorporation of non-canonical amino acids can render new properties and functions to lantibiotics. Nisin is the most studied lantibiotic and contains no tryptophan residues. In this study, a system was constructed to incorporate tryptophan analogues into nisin, which included the modification machinery (NisBTC) and the overexpression of tryptophanyl-tRNA synthetase (TrpRS). Tryptophan and three different tryptophan analogues (5-fluoroTrp (5FW), 5-hydroxyTrp (5HW) and 5-methylTrp (5MeW)) were successfully incorporated at four different positions of nisin (I1W, I4W, M17W and V32W). The incorporation efficiency of tryptophan analogues into mutants I1W, M17W and V32W was over 97 %, while the mutant I4W showed relatively low incorporation efficiency (69-93 %). The variants with 5FW showed relatively higher production yield, while 5MeW-containing variants showed the lowest yield. The dehydration efficiency of serines or threonines was affected by the tryptophan mutants of I4W and V32W. The affinity of the peptides for the cation-ion exchange and reverse phase chromatography columns was significantly reduced when 5HW was incorporated. The antimicrobial activity of IIW and its 5FW analogue both decreased two times compared to that of nisin, while that of its 5HW analogue decreased four times. The 5FW analogue of I4W also showed two times decreased activity than nisin. However, the mutant M17W and its 5HW analogue both showed 32 times reduced activity relative to that of nisin.

  2. Insulin analogues and cancer: a note of caution

    Directory of Open Access Journals (Sweden)

    Joseph A.M.J.L. eJanssen

    2014-05-01

    Full Text Available Abstract In view of the lifelong exposure and large patient populations involved, insulin analogues with an increased mitogenic effect in comparison to human insulin may potentially constitute a major health problem, since these analogues may possibly induce the growth of pre-existing neoplasms. At present, the available data suggest that insulin analogues are safe. In line with these findings, we observed that serum of diabetic patients treated with insulin analogues, compared to that of diabetic patients treated with human insulin, did not induce an increased phosphorylation of tyrosine residues of the insulin-like growth factor-I receptor (IGF-IR. However, the classical model of the IGF-IR signaling may be insufficient to explain (all mitogenic effects of insulin analogues since also non-canonical signaling pathways of the IGF-IR may play a major role in this respect. Although phosphorylation of tyrosine residues of the IGF-IR is generally considered to be the initial activation step within the intracellular IGF-IR signaling pathway, it has been found that cells undergo a signaling switch under hyperglycemic conditions. After this switch, a completely different mechanism is utilized to activate the mitogenic (mitogen-activated protein kinase (MAPK pathways of the IGF-IR that is independent from tyrosine phosphorylation of the IGF-IR. At present it is unknown whether activation of this alternative intracellular pathway of the IGF-IR occurs during hyperglycemia in vivo and whether it is stronger in patients treated with (some insulin analogues than in patients treated with human insulin. In addition, it is unknown whether the insulin receptors (IRs also undergo a signaling switch during hyperglycemia. This should be investigated in future studies. Finally, relative overexpression of IR isoform A (IR-A in (pre cancer tissues may play a key role in the development and progression of human cancers during treatment with insulin (analogues. Further

  3. Compatibility of temporary pacemaker myocardial pacing leads with magnetic resonance imaging: an ex vivo tissue study.

    Science.gov (United States)

    Pfeil, Alexander; Drobnik, Stefanie; Rzanny, Reinhard; Aboud, Anas; Böttcher, Joachim; Schmidt, Peter; Ortmann, Christian; Mall, Gita; Hekmat, Khosro; Brehm, Bernhard; Reichenbach, Juergen; Mayer, Thomas E; Wolf, Gunter; Hansch, Andreas

    2012-02-01

    The presence of temporary myocardial pacing leads is considered a safety contraindication for magnetic resonance imaging (MRI). The aim of this ex vivo tissue study was to measure the heating effects at the tip of the leads using proton magnetic resonance spectroscopy ((1)HMRS) thermometry. The tissue effects were verified by histological analyses. Pig hearts with implanted temporary pacemaker myocardial pacing leads were examined by whole-body MRI at 1.5 Tesla. The tests were performed either by a sequence with high specific absorption rate (SAR) or by standard clinical sequences with lower SAR. Temperature changes were detected via (1)HMRS thermometry, by monitoring the frequency difference between water protons and the reference signals of N-methyl protons of creatine/phosphocreatine (Cr/PCr) and trimethylamine (TMA). Histology was performed using several staining techniques. Standard low-SAR and high-SAR sequences did not cause significant temperature increases in the myocardial tissue surrounding the implanted leads. There were no histopathological signs of thermal damage around the tips of the leads in any of the hearts or in a control implanted heart not subjected to MRI. The present data suggest that temporary pacemaker myocardial pacing leads may be compatible with MR scanning at 1.5 Tesla. However, further in vivo studies and carefully monitored patient studies are needed before final safety recommendations can be made.

  4. Photon strength functions in Gd isotopes studied from radiative capture of resonance neutrons

    Directory of Open Access Journals (Sweden)

    Kroll J.

    2014-04-01

    Full Text Available The experimental spectra of γ rays following radiative neutron capture on isolated resonances of stable 152,154–158Gd targets were measured by the DANCE calorimeter installed at the Los Alamos Neutron Scattering Center in New Mexico, USA. These spectra were analyzed within the extreme statistical model to get new information on the photon strength functions. Special emphasis was put on study of the scissors vibrational mode present in these isotopes. Our data show that the scissors-mode resonances are built not only on the ground states but also on the excited levels of all studied Gd isotopes. The scissors mode strength observed in 157,159Gd products is significantly higher than in neighboring even-even nuclei 156,158Gd. Such a difference indicates the existence of an odd-even effect in the scissors mode strength. Moreover, there exists no universal parameter-free model of the electric dipole photon strength function describing the experimental data in all of the Gd isotopes studied. The results for the scissors mode are compared with the (γ, γ′ data for the ground-state transitions and with the results from 3He-induced reactions.

  5. Understanding disease processes in multiple sclerosis through magnetic resonance imaging studies in animal models

    Directory of Open Access Journals (Sweden)

    Nabeela Nathoo

    2014-01-01

    Full Text Available There are exciting new advances in multiple sclerosis (MS resulting in a growing understanding of both the complexity of the disorder and the relative involvement of grey matter, white matter and inflammation. Increasing need for preclinical imaging is anticipated, as animal models provide insights into the pathophysiology of the disease. Magnetic resonance (MR is the key imaging tool used to diagnose and to monitor disease progression in MS, and thus will be a cornerstone for future research. Although gadolinium-enhancing and T2 lesions on MRI have been useful for detecting MS pathology, they are not correlative of disability. Therefore, new MRI methods are needed. Such methods require validation in animal models. The increasing necessity for MRI of animal models makes it critical and timely to understand what research has been conducted in this area and what potential there is for use of MRI in preclinical models of MS. Here, we provide a review of MRI and magnetic resonance spectroscopy (MRS studies that have been carried out in animal models of MS that focus on pathology. We compare the MRI phenotypes of animals and patients and provide advice on how best to use animal MR studies to increase our understanding of the linkages between MR and pathology in patients. This review describes how MRI studies of animal models have been, and will continue to be, used in the ongoing effort to understand MS.

  6. Nuclear magnetic resonance study of a Bi2Te3 topological insulator

    Science.gov (United States)

    Podorozhkin, D. Yu.; Charnaya, E. V.; Antonenko, A.; Mukhamad'yarov, R.; Marchenkov, V. V.; Naumov, S. V.; Huang, J. C. A.; Weber, H. W.; Bugaev, A. S.

    2015-09-01

    The results of the nuclear magnetic resonance (NMR) study of a grown high-quality Bi2Te3 semiconductor single crystal have been presented. Signals from the 125Te isotope were detected by the spin echo method in the range from 10 K to room temperature. It was found that the NMR spectrum consists of two lines. The line with a positive shift of the resonance frequency corresponded to the bulk of the sample. The line with a negative shift was interpreted as a signal from the surface of the single crystal. The temperature and orientational dependences of the positions of the NMR line of nuclei in the bulk of the crystal were studied. It was shown that the shifts are mainly determined by the Knight shift due to the interaction with mobile charge carriers. The thermoactivation character of the concentration of mobile charges in the crystal under study, which corresponds to the intrinsic conductance, was proved, and the energy parameters of the thermoactivation processes were calculated.

  7. Insulin analogues: have they changed insulin treatment and improved glycaemic control?

    DEFF Research Database (Denmark)

    Madsbad, Sten

    2002-01-01

    To improve insulin therapy, new insulin analogues have been developed. Two fast-acting analogues with a more rapid onset of effect and a shorter duration of action combined with a low day-to-day variation in absorption rate are now available. Despite this favourable time-action profile most studi......, the new fast-acting analogues have not achieved the expected commercial success, which emphasises the need for new strategies for basal insulin supplementation, exercise, diet and blood glucose monitoring....

  8. Study of a DNA Duplex by Nuclear Magnetic Resonance and Molecular Dynamics Simulations. Validation of Pulsed Dipolar Electron Paramagnetic Resonance Distance Measurements Using Triarylmethyl-Based Spin Labels.

    Science.gov (United States)

    Lomzov, Alexander A; Sviridov, Eugeniy A; Shernuykov, Andrey V; Shevelev, Georgiy Yu; Pyshnyi, Dmitrii V; Bagryanskaya, Elena G

    2016-06-16

    Pulse dipole-dipole electron paramagnetic resonance (EPR) spectroscopy (double electron-electron resonance [DEER] or pulse electron-electron double resonance [PELDOR] and double quantum coherence [DQC]) allows for measurement of distances in biomolecules and can be used at low temperatures in a frozen solution. Recently, the possibility of distance measurement in a nucleic acid at a physiological temperature using pulse EPR was demonstrated. In these experiments, triarylmethyl (TAM) radicals with long memory time of the electron spin served as a spin label. In addition, the duplex was immobilized on modified silica gel particles (Nucleosil DMA); this approach enables measurement of interspin distances close to 4.5 nm. Nevertheless, the possible influence of TAM on the structure of a biopolymer under study and validity of the data obtained by DQC are debated. In this paper, a combination of molecular dynamics (MD) and nuclear magnetic resonance (NMR) methods was used for verification of interspin distances measured by the X-band DQC method. NMR is widely used for structural analysis of biomolecules under natural conditions (room temperature and an aqueous solution). The ultraviolet (UV) melting method and thermal series (1)H NMR in the range 5-95 °C revealed the presence of only the DNA duplex in solution at oligonucleotide concentrations 1 μM to 1.1 mM at temperatures below 40 °C. The duplex structures and conformation flexibility of native and TAM-labeled DNA complexes obtained by MD simulation were the same as the structure obtained by NMR refinement. Thus, we showed that distance measurements at physiological temperatures by the X-band DQC method allow researchers to obtain valid structural information on an unperturbed DNA duplex using terminal TAM spin labels.

  9. Analogue cosmology in a hadronic fluid

    Directory of Open Access Journals (Sweden)

    Bilić Neven

    2014-01-01

    Full Text Available Analog gravity models of general relativity seem promising routes to providing laboratory tests of the foundation of quantum field theory in curved space-time. In contrast to general relativity, where geometry of a spacetime is determined by the Einstein equations, in analog models geometry and evolution of analog spacetime are determined by the equations of fluid mechanics. In this paper we study the analogue gravity model based on massless pions propagating in a expanding hadronic fluid. The analog expanding spacetime takes the form of an FRW universe, with the apparent and trapping horizons defined in the standard way.

  10. A feasibility study of magnetic resonance imaging of silicone breast implants in Finland

    DEFF Research Database (Denmark)

    Kulmala, Ilona; Boice, John D; McLaughlin, Joseph K

    2005-01-01

    to determine the feasibility of conducting a magnetic resonance imaging (MRI)-based study of rupture incidence. The pilot investigation included a clinical examination by a plastic surgeon, MRI scan, and self-administered questionnaire. The participation rate was 100%. Implants in our study represented a cross...... the other diagnosed all implants as intact. The procedures of the feasibility study proved successful, and the results demonstrate the importance of a rigid image evaluation protocol with employment of well-defined rupture criteria, as well as the benefits of several image readers.......Cosmetic breast implants have become increasingly popular throughout the world. However, there is insufficient knowledge about the frequency and severity of local complications such as rupture and capsular contracture. A pilot study of 25 Finnish women with 50 cosmetic breast implants was organized...

  11. Neuronal Analogues of Conditioning Paradigms

    Science.gov (United States)

    1984-04-24

    Although the mechanisms of interneuronal communication have been well established, the changes underlying most forms of learning have thus far eluded...stimulating electrodes on one of the connectives was adjusted so as to produce a small excitatory postsynaptic potential ( EPSP ) in the impaled cell...two stimuli would constitute a neuronal analogue of conditioning by producing an increased EPSP in response to the test stimulus alone. If so, then

  12. Study of Resonances in Exclusive B Decays to Dbar(*)D(*)K

    CERN Document Server

    Aubert, B; Boutigny, D; Karyotakis, Yu; Lees, J P; Poireau, V; Prudent, X; Tisserand, V; Zghiche, A; Garra Tico, J; Graugès-Pous, E; López, L; Palano, A; Pappagallo, M; Eigen, G; Stugu, B; Sun, L; Abrams, G S; Battaglia, M; Brown, D N; Button-Shafer, J; Cahn, R N; Groysman, Y; Jacobsen, R G; Kadyk, J A; Kerth, L T; Kolomensky, Yu G; Kukartsev, G; Lopes-Pegna, D; Lynch, G; Mir, L M; Orimoto, T J; Osipenkov, I L; Ronan, M T; Tackmann, K; Tanabé, T; Wenzel, W A; Del Amo-Sánchez, P; Hawkes, C M; Watson, A T; Koch, H; Schröder, T; Walker, D; Asgeirsson, D J; Çuhadar-Dönszelmann, T; Fulsom, B G; Hearty, C; Mattison, T S; McKenna, J A; Khan, A; Saleem, M; Teodorescu, L; Blinov, V E; Bukin, A D; Druzhinin, V P; Golubev, V B; Onuchin, A P; Serednyakov, S I; Skovpen, Yu I; Solodov, E P; Todyshev, K Yu; Bondioli, M; Curry, S; Eschrich, I; Kirkby, D; Lankford, A J; Lund, P; Mandelkern, M; Martin, E C; Stoker, D P; Abachi, S; Buchanan, C; Foulkes, S D; Gary, J W; Liu, F; Long, O; Shen, B C; Vitug, G M; Zhang, L; Paar, H P; Rahatlou, S; Sharma, V; Berryhill, J W; Campagnari, C; Cunha, A; Dahmes, B; Hong, T M; Kovalskyi, D; Richman, J D; Beck, T W; Eisner, A M; Flacco, C J; Heusch, C A; Kroseberg, J; Lockman, W S; Schalk, T; Schumm, B A; Seiden, A; Wilson, M G; Winstrom, L O; Chen, E; Cheng, C H; Fang, F; Hitlin, D G; Narsky, I; Piatenko, T; Porter, F C; Andreassen, R; Mancinelli, G; Meadows, B T; Mishra, K; Sokoloff, M D; Blanc, F; Bloom, P C; Chen, S; Ford, W T; Hirschauer, J F; Kreisel, A; Nagel, M; Nauenberg, U; Olivas, A; Smith, J G; Ulmer, K A; Wagner, S R; Zhang, J; Gabareen, A M; Soffer, A; Toki, W H; Wilson, R J; Winklmeier, F; Altenburg, D D; Feltresi, E; Hauke, A; Jasper, H; Merkel, J; Petzold, A; Spaan, B; Wacker, K; Klose, V; Kobel, M J; Lacker, H M; Mader, W F; Nogowski, R; Schubert, J; Schubert, K R; Schwierz, R; Sundermann, J E; Volk, A; Bernard, D; Bonneaud, G R; Latour, E; Lombardo, V; Thiebaux, C; Verderi, M; Clark, P J; Gradl, W; Muheim, F; Playfer, S; Robertson, A I; Watson, J E; Xie, Y; Andreotti, M; Bettoni, D; Bozzi, C; Calabrese, R; Cecchi, A; Cibinetto, G; Franchini, P; Luppi, E; Negrini, M; Petrella, A; Piemontese, L; Prencipe, E; Santoro, V; Anulli, F; Baldini-Ferroli, R; Calcaterra, A; De Sangro, R; Finocchiaro, G; Pacetti, S; Patteri, P; Peruzzi, I M; Piccolo,M; Rama, M; Zallo, A; Buzzo, A; Contri, R; Lo Vetere, M; Macri, M M; Monge, M R; Passaggio, S; Patrignani, C; Robutti, E; Santroni, A; Tosi, S; Chaisanguanthum, K S; Morii, M; Wu, J; Dubitzky, R S; Marks, J; Schenk, S; Uwer, U; Bard, D J; Dauncey, P D; Flack, R L; Nash, J A; Panduro-Vazquez, W; Tibbetts, M; Behera, P K; Chai, X; Charles, M J; Mallik, U; Cochran, J; Crawley, H B; Dong, L; Eyges, V; Meyer, W T; Prell, S; Rosenberg, E I; Rubin, A E; Gao, Y Y; Gritsan, A V; Guo, Z J; Lae, C K; Denig, A G; Fritsch, M; Schott, G; Arnaud, N; Bequilleux, J; D'Orazio, A; Davier, M; Grosdidier, G; Höcker, A; Lepeltier, V; Le Diberder, F; Lutz, A M; Pruvot, S; Rodier, S; Roudeau, P; Schune, M H; Serrano, J; Sordini, V; Stocchi, A; Wang, W F; Wormser, G; Lange, D J; Wright, D M; Bingham, I; Chavez, C A; Fry, J R; Gabathuler, E; Gamet, R; Hutchcroft, D E; Payne, D J; Schofield, K C; Touramanis, C; Bevan, A J; George, K A; Di Lodovico, F; Sacco, R; Cowan, G; Flächer, H U; Hopkins, D A; Paramesvaran, S; Salvatore, F; Wren, A C; Brown, D N; Davis, C L; Allison, J; Bailey, D; Barlow, N R; Barlow, R J; Chia, Y M; Edgar, C L; Lafferty, G D; West, T J; Yi, J I; Anderson, J; Chen, C; Jawahery, A; Roberts, D A; Simi, G; Tuggle, J M; Blaylock, G; Dallapiccola, C; Hertzbach, S S; Li, X; Moore, T B; Salvati, E; Saremi, S; Cowan, R; Dujmic, D; Fisher, P H; Koeneke, K; Sciolla, G; Spitznagel, M; Taylor, F; Yamamoto, R K; Zhao, M; Zheng, Y; Mclachlin, S E; Patel, P M; Robertson, S H; Lazzaro, A; Palombo, F; Bauer, J M; Cremaldi, L; Eschenburg, V; Godang, R; Kroeger, R; Sanders, D A; Summers, D J; Zhao, H W; Brunet, S; Côté, D; Simard, M; Taras, P; Viaud, F B; Nicholson, H; De Nardo, Gallieno; Fabozzi, F; Lista, L; Monorchio, D; Sciacca, C; Baak, M A; Raven, G; Snoek, H L; Jessop, C P; Knoepfel, K J; LoSecco, J M; Benelli, G; Corwin, L A; Honscheid, K; Kagan, H; Kass, R; Morris, J P; Rahimi, A M; Regensburger, J J; Sekula, S J; Wong, Q K; Blount, N L; Brau, J E; Frey, R; Igonkina, O; Kolb, J A; Lu, M; Rahmat, R; Sinev, N B; Strom, D; Strube, J; Torrence, E; Gagliardi, N; Gaz, A; Margoni, M; Morandin, M; Pompili, A; Posocco, M; Rotondo, M; Simonetto, F; Stroili, R; Voci, C; Ben-Haim, E; Briand, H; Calderini, G; Chauveau, J; David, P; Del Buono, L; De La Vaissière, C; Hamon, O; Leruste, P; Malcles, J; Ocariz, J; Pérez, A; Prendki, J; Gladney, L; Biasini, M; Covarelli, R; Manoni, E; Angelini, C; Batignani, G; Bettarini, S; Carpinelli, M; Cenci, R; Cervelli, A; Forti, F; Giorgi, M A; Lusiani, A; Marchiori, G; Mazur, M A; Morganti, M; Neri, N; Paoloni, E; Rizzo, G; Walsh, J J; Biesiada, J; Elmer, P; Lau, Y P; Lü, C; Olsen, J; Smith, A J S; Telnov, A V; Baracchini, E; Bellini, F; Cavoto, G; Del Re, D; Di Marco, E; Faccini, R; Ferrarotto, F; Ferroni, F; Gaspero, M; Jackson, P D; Li Gioi, L; Mazzoni, M A; Morganti, S; Piredda, G; Polci, F; Renga, F; Voena, C; Ebert, M; Hartmann, T; Schröder, H; Waldi, R; Adye, T; Castelli, G; Franek, B; Olaiya, E O; Röthel, W; Wilson, F F; Emery, S; Escalier, M; Gaidot, A; Ganzhur, S F; Hamel de Monchenault, G; Kozanecki, W; Vasseur, G; Yéche, C; Zito, M; Chen, X R; Liu, H; Park, W; Purohit, M V; White, R M; Wilson, J R; Allen, M T; Aston, D; Bartoldus, R; Bechtle, P; Claus, R; Coleman, J P; Convery, M R; Dingfelder, J C; Dorfan, J; Dubois-Felsmann, G P; Dunwoodie, W; Field, R C; Glanzman, T; Gowdy, S J; Graham, M T; Grenier, P; Hast, C; Innes, W R; Kaminski, J; Kelsey, M H; Kim, H; Kim, P; Kocian, M L; Leith, D W G S; Li, S; Luitz, S; Lüth, V; Lynch, H L; MacFarlane, D B; Marsiske, H; Messner, R; Müller, D R; O'Grady, C P; Ofte, I; Perazzo, A; Perl, M; Pulliam, T; Ratcliff, B N; Roodman, A; Salnikov, A A; Schindler, R H; Schwiening, J; Snyder, A; Su, D; Sullivan, M K; Suzuki, K; Swain, S K; Thompson, J M; Vavra, J; Wagner, A P; Weaver, M; Wisniewski, W J; Wittgen, M; Wright, D H; Yarritu, A K; Yi, K; Young, C C; Ziegler, V; Burchat, P R; Edwards, A J; Majewski, S A; Miyashita, T S; Petersen, B A; Wilden, L; Ahmed, S; Alam, M S; Bula, R; Ernst, J A; Jain, V; Pan, B; Saeed, M A; Wappler, F R; Zain, S B; Krishnamurthy, M; Spanier, S M; Eckmann, R; Ritchie, J L; Ruland, A M; Schilling, C J; Schwitters, R F; Izen, J M; Lou, X C; Ye, S; Bianchi, F; Gallo, F; Gamba, D; Pelliccioni, M; Bomben, M; Bosisio, L; Cartaro, C; Cossutti, F; Della Ricca, G; Lanceri, L; Vitale, L; Azzolini, V; Lopez-March, N; Martínez-Vidal, F; Milanes, D A; Oyanguren, A; Albert, J; Banerjee, Sw; Bhuyan, B; Hamano, K; Kowalewski, R; Nugent, I M; Roney, J M; Sobie, R J; Harrison, P F; Ilic, J; Latham, T E; Mohanty, G B; Band, H R; Chen, X; Dasu, S; Flood, K T; Hollar, J J; Kutter, P E; Pan, Y; Pierini, M; Prepost, R; Wu, S L; Neal, H

    2007-01-01

    We present a study of resonances in exclusive decays of $B$ mesons to $\\bar{D}^{(*)} D^{(*)} K$. We report the observation of the decays $B \\to \\bar{D}^{(*)} D^+_{s1}(2536)$ where the $D^+_{s1}(2536)$ is reconstructed in the $D^{*0}K^+$ and $D^{*+} K^0_S$ decay channels. We report also the observation of the decays $B \\to \\psi(3770) K$ where the $\\psi(3770)$ decays to $\\bar{D}^0 D^0$ and $D^-D^+$. In addition, we present the observation of an enhancement for the $\\bar{D}^{*0}D^0$ invariant mass in the decays $B \\to \\bar{D}^{*0}D^0K$, at a mass of $(3875.1 \\pm 1.1 \\pm 0.5)$ MeV/$c^2$ with a width of $(3.0 {}^{+4.6}_{-2.3} \\pm 0.9)$ MeV (the first errors are statistical and the second are systematic). Branching fractions and spin studies are shown for the three resonances. The results are based on 347 fb$^{-1}$ of data collected with the BaBar detector at the PEP-II $B$ factory.

  13. Air oxidation of the kerogen/asphaltene vanadyl porphyrins: an electron spin resonance study

    Directory of Open Access Journals (Sweden)

    MIRJANA S. PAVLOVIC

    2000-02-01

    Full Text Available The thermal behavior of vanadyl porphyrins was studied by electron spin resonance during heating of kerogens, isolated from the La Luna (Venezuela and Serpiano (Switzerland bituminous rocks, at 25°C for 1 to 20 days in the presence of air. During the thermal treatment of the kerogens, the vanadyl porphyrins resonance signals decrease monotonically and become quite small after 6 days of heating. Concomitantly, new vanadyl signals appear and, at longer heating times, dominate the spectrum. It is suggested that the secondary vanadyl species must have been formed from vanadyl porphyrins. Similar conversions of vanadyl porphyrins are observed under the same experimental conditions for asphaltenes extracted from the La Luna and Serpiano rocks, and floating asphalt from the Dead Sea (Israel. A comparison of the spin-Hamiltonian parameters for vanadyl porphyrins and the vanadyl compounds obtained during pyrolysis of the kerogens/asphaltenes suggests that the latter are of a non-porphyrin type. For comparison a study was conducted on Western Kentucky No. 9 coal enriched with vanadium (>>400 ppm from six mines. All the coal samples show only the presence of predominant by non-porphyrin vanadyl compounds, similar to those generated through laboratory heating of the kerogens/asphaltenes in air. In addition, some samples also contain a minor amount of vanadyl porphyrins.

  14. Novel acetylcholine and carbamoylcholine analogues

    DEFF Research Database (Denmark)

    Hansen, Camilla Petrycer; Jensen, Anders Asbjørn; Christensen, Jeppe K.;

    2008-01-01

    A series of carbamoylcholine and acetylcholine analogues were synthesized and characterized pharmacologically at neuronal nicotinic acetylcholine receptors (nAChRs). Several of the compounds displayed low nanomolar binding affinities to the alpha 4beta 2 nAChR and pronounced selectivity for this ......A series of carbamoylcholine and acetylcholine analogues were synthesized and characterized pharmacologically at neuronal nicotinic acetylcholine receptors (nAChRs). Several of the compounds displayed low nanomolar binding affinities to the alpha 4beta 2 nAChR and pronounced selectivity...... for this subtype over alpha 3beta 4, alpha 4beta 4, and alpha 7 nAChRs. The high nAChR activity of carbamoylcholine analogue 5d was found to reside in its R-enantiomer, a characteristic most likely true for all other compounds in the series. Interestingly, the pronounced alpha 4beta 2 selectivities exhibited......AChR agonists published to date. Ligand-protein docking experiments using homology models of the amino-terminal domains of alpha 4beta 2 and alpha 3beta 4 nAChRs identified residues Val111(beta 2)/Ile113(beta 4), Phe119(beta 2)/Gln121(beta 4), and Thr155(alpha 4)/Ser150(alpha 3) as possible key determinants...

  15. Substrate analogues for isoprenoid enzymes

    Energy Technology Data Exchange (ETDEWEB)

    Stremler, K.E.

    1987-01-01

    Diphosphonate analogues of geranyl diphosphate, resistant to degradation by phosphatases, were found to be alternate substrates for the reaction with farnesyl diphosphate synthetase isolated from avian liver. The difluoromethane analogue was shown to be the better alternate substrate, in agreement with solvolysis results which indicate that the electronegativity of the difluoromethylene unit more closely approximates that of the normal bridging oxygen. The usefulness of the C/sub 10/ difluoro analogue, for detecting low levels of isoprenoid enzymes in the presence of high levels of phosphatase activity, was demonstrated with a cell-free preparation from lemon peel. A series of C/sub 5/ through C/sub 15/ homoallylic and allylic diphosphonates, as well as two 5'-nucleotide diphosphonates, was prepared in high overall yield using the activation-displacement sequence. Radiolabeled samples of several of the allylic diphosphonates were prepared with tritium located at C1. A series of geraniols, stereospecifically deuterated at C1, was prepared. The enantiomeric purities and absolute configurations were determined by derivatization as the mandelate esters for analysis by /sup 1/H NMR. The stereochemistry of the activation-displacement sequence was examined using C1-deuterated substrates.

  16. Application of the confluent Heun functions to study the physics of black holes: resonant frequencies and scattering of scalar waves

    CERN Document Server

    Vieira, H S

    2016-01-01

    We study the scattering and the resonant frequencies (quasispectrum) of charged massive scalar waves by Kerr-Newman-Kasuya spacetime (dyon black hole). The equations of motion are written into a Heun form, and its analytical solutions are obtained. We obtain the resonant frequencies expression and the general exact regular partial wave solution. The special cases of the Kerr and Schwarzschild black holes are analyzed and the solutions are shown.

  17. Resonating Statements

    DEFF Research Database (Denmark)

    Hjelholt, Morten; Jensen, Tina Blegind

    2015-01-01

    IT projects are often complex arrangements of technological components, social actions, and organizational transformation that are difficult to manage in practice. This paper takes an analytical discourse perspective to explore the process of legitimizing IT projects. We introduce the concept...... of resonating statements to highlight how central actors navigate in various discourses over time. Particularly, the statements and actions of an IT project manager are portrayed to show how individuals can legitimize actions by connecting statements to historically produced discourses. The case study...... of an IT project in a Danish local government spans a two-year time period and demonstrates a double-loop legitimization process. First, resonating statements are produced to localize a national IT initiative to support the specificity of a local government discourse. Second, the resonating statements are used...

  18. Improved selectivity for Pb(II) by sulfur, selenium and tellurium analogues of 1,8-anthraquinone-18-crown-5: synthesis, spectroscopy, X-ray crystallography and computational studies.

    Science.gov (United States)

    Mariappan, Kadarkaraisamy; Alaparthi, Madhubabu; Hoffman, Mariah; Rama, Myriam Alcantar; Balasubramanian, Vinothini; John, Danielle M; Sykes, Andrew G

    2015-07-14

    We report here a series of heteroatom-substituted macrocycles containing an anthraquinone moiety as a fluorescent signaling unit and a cyclic polyheteroether chain as the receptor. Sulfur, selenium, and tellurium derivatives of 1,8-anthraquinone-18-crown-5 (1) were synthesized by reacting sodium sulfide (Na2S), sodium selenide (Na2Se) and sodium telluride (Na2Te) with 1,8-bis(2-bromoethylethyleneoxy)anthracene-9,10-dione in a 1 : 1 ratio. The optical properties of the new compounds are examined and the sulfur and selenium analogues produce an intense green emission enhancement upon association with Pb(II) in acetonitrile. Selectivity for Pb(II) is markedly improved as compared to the oxygen analogue 1 which was also competitive for Ca(II) ion. UV-Visible and luminescence titrations reveal that 2 and 3 form 1 : 1 complexes with Pb(II), confirmed by single-crystal X-ray studies where Pb(II) is complexed within the macrocycle through coordinate covalent bonds to neighboring carbonyl, ether and heteroether donor atoms. Cyclic voltammetry of 2-8 showed classical, irreversible oxidation potentials for sulfur, selenium and tellurium heteroethers in addition to two one-electron reductions for the anthraquinone carbonyl groups. DFT calculations were also conducted on 1, 2, 3, 6, 6 + Pb(II) and 6 + Mg(II) to determine the trend in energies of the HOMO and the LUMO levels along the series.

  19. Analogue Magnetism Revisited

    CERN Document Server

    Osano, Bob

    2016-01-01

    In this article we revisit the significance of the often debated structural similarity between the equations of electromagnetism and fluid dynamics. Although the matching of the two sets of equations has successfully been done for non-dissipative forms of the equations, little has been done for cases where the dissipative terms are non-negligible. We consider the consequence of non-negligible viscosity and diffusivity, and how the fine-tuning of these parameters could allow fluid dynamics to be used to indirectly study certain properties of magnetic fields.

  20. Aortic dimensions in girls and young women with turner syndrome: a magnetic resonance imaging study

    DEFF Research Database (Denmark)

    Mortensen, Kristian H; Skouby, Sven O; Leffers, Anne-Mette

    2010-01-01

    This study aimed to determine the dimensions of the thoracic aorta and the predictors of aortic dimensions in girls and young women with Turner syndrome (TS). A cross-sectional study was performed at a secondary care center. The study compared 41 TS patients with 50 healthy age-matched control...... subjects. The mean age of the patients was 17 +/- 3.3 years. Magnetic resonance imaging was performed for all the patients. The thoracic aortic diameters of the patients were measured at nine positions. Adjustment for body surface area (BSA) was performed. The outcome for the patients was measured in terms...... and in five TS patients after BSA-adjustment. The aortic diameters correlated with height, weight, body mass index (BMI), and BSA at all positions (R = 0.34-0.60; all p aorta correlated with a history of aortic coarctation (R = 0.35-0.52; p

  1. Controlled analogue experiments on propagation of seismic electromagnetic signals

    Institute of Scientific and Technical Information of China (English)

    HUANG Qinghua

    2005-01-01

    This study presented a method of laboratory analogue experiments based on a geographical scaling model and a waveguide model to investigate the characteristics of the propagation of seismic electromagnetic signals in the crust and the atmosphere. Some controlled experiments were done to evaluate the possible influence on the experimental results from the background electromagnetic field, geographical conditions, boundary effects, the source of electromagnetic signals (position, magnitude, and frequency), and media conductivity. The reliability and the extensibility of the above analogue experimental method were also investigated. This study indicated that such kind of analogue experimental method provided an intuitionistic way of studying the propagation of seismic electromagnetic signals, which is one of the most difficult research topics in seismo-electro- magnetism.

  2. NATO Advanced Study Institute on Magnetic Resonance : Introduction, Advanced Topics and Applications to Fossil Energy

    CERN Document Server

    Fraissard, Jacques

    1984-01-01

    This volume contains the lectures presented at an Advanced Study Institute on "Magnetic Resonance Techniques in Fossil Energy Problems," which was held at the village of Maleme, Crete, in July of 1983. As of this writing, a different popular attitude prevails from that when the ASI was proposed as far as how critical the world energy picture is. In the popular press, a panglossian attitude (the "petroleum glut" of the 80's) has replaced the jeremiads of the 70's ( a catastrophic "energy crisis"). Yet, there are certain important constants: (a) for the foreseeable future, fossil energy sources (petroleum, coal, oil shale, etc. ) will continue to be of paramount importance; and (b) science and technology of the highest order are needed to extend the fossil ener~y resource base and to utilize it in a cost-effective manner that is also environmentally acceptable. It is precisely this second item that this volume addresses. The volume introduces the phenomenology of magnetic resonance ~n a unified and detailed man...

  3. Study of orbitally excited $B$ mesons and evidence for a new $B\\pi$ resonance

    CERN Document Server

    Aaltonen, Timo Antero; Amidei, Dante E; Anastassov, Anton Iankov; Annovi, Alberto; Antos, Jaroslav; Apollinari, Giorgio; Appel, Jeffrey A; Arisawa, Tetsuo; Artikov, Akram Muzafarovich; Asaadi, Jonathan A; Ashmanskas, William Joseph; Auerbach, Benjamin; Aurisano, Adam J; Azfar, Farrukh A; Badgett, William Farris; Bae, Taegil; Barbaro-Galtieri, Angela; Barnes, Virgil E; Barnett, Bruce Arnold; Barria, Patrizia; Bartos, Pavol; Bauce, Matteo; Bedeschi, Franco; Behari, Satyajit; Bellettini, Giorgio; Bellinger, James Nugent; Benjamin, Douglas P; Beretvas, Andrew F; Bhatti, Anwar Ahmad; Bland, Karen Renee; Blumenfeld, Barry J; Bocci, Andrea; Bodek, Arie; Bortoletto, Daniela; Boudreau, Joseph Francis; Boveia, Antonio; Brigliadori, Luca; Bromberg, Carl Michael; Brucken, Erik; Budagov, Ioulian A; Budd, Howard Scott; Burkett, Kevin Alan; Busetto, Giovanni; Bussey, Peter John; Butti, Pierfrancesco; Buzatu, Adrian; Calamba, Aristotle; Camarda, Stefano; Campanelli, Mario; Canelli, Florencia; Carls, Benjamin; Carlsmith, Duncan L; Carosi, Roberto; Carrillo Moreno, Salvador; Casal Larana, Bruno; Casarsa, Massimo; Castro, Andrea; Catastini, Pierluigi; Cauz, Diego; Cavaliere, Viviana; Cavalli-Sforza, Matteo; Cerri, Alessandro; Cerrito, Lucio; Chen, Yen-Chu; Chertok, Maxwell Benjamin; Chiarelli, Giorgio; Chlachidze, Gouram; Cho, Kihyeon; Chokheli, Davit; Clark, Allan Geoffrey; Clarke, Christopher Joseph; Convery, Mary Elizabeth; Conway, John Stephen; Corbo, Matteo; Cordelli, Marco; Cox, Charles Alexander; Cox, David Jeremy; Cremonesi, Matteo; Cruz Alonso, Daniel; Cuevas Maestro, Javier; Culbertson, Raymond Lloyd; D'Ascenzo, Nicola; Datta, Mousumi; de Barbaro, Pawel; Demortier, Luc M; Marchese, Luigi Marchese; Deninno, Maria Maddalena; Devoto, Francesco; D'Errico, Maria; Di Canto, Angelo; Di Ruzza, Benedetto; Dittmann, Jay Richard; D'Onofrio, Monica; Donati, Simone; Dorigo, Mirco; Driutti, Anna; Ebina, Koji; Edgar, Ryan Christopher; Elagin, Andrey L; Erbacher, Robin D; Errede, Steven Michael; Esham, Benjamin; Farrington, Sinead Marie; Feindt, Michael; Fernández Ramos, Juan Pablo; Field, Richard D; Flanagan, Gene U; Forrest, Robert David; Franklin, Melissa EB; Freeman, John Christian; Frisch, Henry J; Funakoshi, Yujiro; Galloni, Camilla; Garfinkel, Arthur F; Garosi, Paola; Gerberich, Heather Kay; Gerchtein, Elena A; Giagu, Stefano; Giakoumopoulou, Viktoria Athina; Gibson, Karen Ruth; Ginsburg, Camille Marie; Giokaris, Nikos D; Giromini, Paolo; Giurgiu, Gavril A; Glagolev, Vladimir; Glenzinski, Douglas Andrew; Gold, Michael S; Goldin, Daniel; Golossanov, Alexander; Gomez, Gervasio; Gomez-Ceballos, Guillelmo; Goncharov, Maxim T; González López, Oscar; Gorelov, Igor V; Goshaw, Alfred T; Goulianos, Konstantin A; Gramellini, Elena; Grinstein, Sebastian; Grosso-Pilcher, Carla; Group, Robert Craig; Barreiro Guimaraes da Costa, Joao; Hahn, Stephen R; Han, Ji-Yeon; Happacher, Fabio; Hara, Kazuhiko; Hare, Matthew Frederick; Harr, Robert Francis; Harrington-Taber, Timothy; Hatakeyama, Kenichi; Hays, Christopher Paul; Heinrich, Joel G; Herndon, Matthew Fairbanks; Hocker, James Andrew; Hong, Ziqing; Hopkins, Walter Howard; Hou, Suen Ray; Hughes, Richard Edward; Husemann, Ulrich; Hussein, Mohammad; Huston, Joey Walter; Introzzi, Gianluca; Iori, Maurizio; Ivanov, Andrew Gennadievich; James, Eric B; Jang, Dongwook; Jayatilaka, Bodhitha Anjalike; Jeon, Eun-Ju; Jindariani, Sergo Robert; Jones, Matthew T; Joo, Kyung Kwang; Jun, Soon Yung; Junk, Thomas R; Kambeitz, Manuel; Kamon, Teruki; Karchin, Paul Edmund; Kasmi, Azeddine; Kato, Yukihiro; Ketchum, Wesley Robert; Keung, Justin Kien; Kilminster, Benjamin John; Kim, DongHee; Kim, Hyunsoo; Kim, Jieun; Kim, Min Jeong; Kim, Soo Bong; Kim, Shin-Hong; Kim, Young-Kee; Kim, Young-Jin; Kimura, Naoki; Kirby, Michael H; Knoepfel, Kyle James; Kondo, Kunitaka; Kong, Dae Jung; Konigsberg, Jacobo; Kotwal, Ashutosh Vijay; Kreps, Michal; Kroll, IJoseph; Kruse, Mark Charles; Kuhr, Thomas; Kurata, Masakazu; Laasanen, Alvin Toivo; Lammel, Stephan; Lancaster, Mark; Lannon, Kevin Patrick; Latino, Giuseppe; Heck, Martin; Lee, Hyun Su; Lee, Jaison; Leo, Sabato; Leone, Sandra; Lewis, Jonathan D; Limosani, Antonio; Lipeles, Elliot David; Lister, Alison; Liu, Hao; Liu, Qiuguang; Liu, Tiehui Ted; Lockwitz, Sarah E; Loginov, Andrey Borisovich; Lucà, Alessandra; Lucchesi, Donatella; Lueck, Jan; Lujan, Paul Joseph; Lukens, Patrick Thomas; Lungu, Gheorghe; Lys, Jeremy E; Lysak, Roman; Madrak, Robyn Leigh; Maestro, Paolo; Malik, Sarah Alam; Manca, Giulia; Manousakis-Katsikakis, Arkadios; Margaroli, Fabrizio; Marino, Christopher Phillip; Martínez-Perez, Mario; Matera, Keith; Mattson, Mark Edward; Mazzacane, Anna; Mazzanti, Paolo; McNulty, Ronan; Mehta, Andrew; Mehtala, Petteri; Mesropian, Christina; Miao, Ting; Mietlicki, David John; Mitra, Ankush; Miyake, Hideki; Moed, Shulamit; Moggi, Niccolo; Moon, Chang-Seong; Moore, Ronald Scott; Morello, Michael Joseph; Mukherjee, Aseet; Muller, Thomas; Murat, Pavel A; Mussini, Manuel; Nachtman, Jane Marie; Nagai, Yoshikazu; Naganoma, Junji; Nakano, Itsuo; Napier, Austin; Nett, Jason Michael; Neu, Christopher Carl; Nigmanov, Turgun S; Nodulman, Lawrence J; Noh, Seoyoung; Norniella Francisco, Olga; Oakes, Louise Beth; Oh, Seog Hwan; Oh, Young-do; Oksuzian, Iuri Artur; Okusawa, Toru; Orava, Risto Olavi; Ortolan, Lorenzo; Pagliarone, Carmine Elvezio; Palencia, Jose Enrique; Palni, Prabhakar; Papadimitriou, Vaia; Parker, William Chesluk; Pauletta, Giovanni; Paulini, Manfred; Paus, Christoph Maria Ernst; Phillips, Thomas J; Piacentino, Giovanni M; Pianori, Elisabetta; Pilot, Justin Robert; Pitts, Kevin T; Plager, Charles; Pondrom, Lee G; Poprocki, Stephen; Potamianos, Karolos Jozef; Prokoshin, Fedor; Pranko, Aliaksandr Pavlovich; Ptohos, Fotios K; Punzi, Giovanni; Ranjan, Niharika; Redondo Fernández, Ignacio; Renton, Peter B; Rescigno, Marco; Rimondi, Franco; Ristori, Luciano; Robson, Aidan; Rodriguez, Tatiana Isabel; Rolli, Simona; Ronzani, Manfredi; Roser, Robert Martin; Rosner, Jonathan L; Ruffini, Fabrizio; Ruiz Jimeno, Alberto; Russ, James S; Rusu, Vadim Liviu; Sakumoto, Willis Kazuo; Sakurai, Yuki; Santi, Lorenzo; Sato, Koji; Saveliev, Valeri; Savoy-Navarro, Aurore; Schlabach, Philip; Schmidt, Eugene E; Schwarz, Thomas A; Scodellaro, Luca; Scuri, Fabrizio; Seidel, Sally C; Seiya, Yoshihiro; Semenov, Alexei; Sforza, Federico; Shalhout, Shalhout Zaki; Shears, Tara G; Shepard, Paul F; Shimojima, Makoto; Shochet, Melvyn J; Tecker-Shreyber, Irina; Simonenko, Alexander V; Sliwa, Krzysztof Jan; Smith, John Rodgers; Snider, Frederick Douglas; Sorin, Maria Veronica; Song, Hao; Stancari, Michelle Dawn; St Denis, Richard Dante; Stentz, Dale James; Strologas, John; Sudo, Yuji; Sukhanov, Alexander I; Suslov, Igor M; Takemasa, Ken-ichi; Takeuchi, Yuji; Tang, Jian; Tecchio, Monica; Teng, Ping-Kun; Thom, Julia; Thomson, Evelyn Jean; Thukral, Vaikunth; Toback, David A; Tokar, Stanislav; Tollefson, Kirsten Anne; Tomura, Tomonobu; Tonelli, Diego; Torre, Stefano; Torretta, Donatella; Totaro, Pierluigi; Trovato, Marco; Ukegawa, Fumihiko; Uozumi, Satoru; Vázquez-Valencia, Elsa Fabiola; Velev, Gueorgui; Vellidis, Konstantinos; Vernieri, Caterina; Vidal Marono, Miguel; Vilar Cortabitarte, Rocio; Vizán Garcia, Jesus Manuel; Vogel, Marcelo; Volpi, Guido; Wagner, Peter; Wallny, Rainer S; Wang, Song-Ming; Waters, David S; Wester, William Carl; Whiteson, Daniel O; Wicklund, Arthur Barry; Wilbur, Scott; Williams, Hugh H; Wilson, Jonathan Samuel; Wilson, Peter James; Winer, Brian L; Wittich, Peter; Wolbers, Stephen A; Wolfe, Homer; Wright, Thomas Roland; Wu, Xin; Wu, Zhenbin; Yamamoto, Kazuhiro; Yamato, Daisuke; Yang, Tingjun; Yang, Un-Ki; Yang, Yu Chul; Yao, Wei-Ming; Yeh, Gong Ping; Yi, Kai; Yoh, John; Yorita, Kohei; Yoshida, Takuo; Yu, Geum Bong; Yu, Intae; Zanetti, Anna Maria; Zeng, Yu; Zhou, Chen; Zucchelli, Stefano

    2014-01-01

    Using the full CDF Run II data sample, we report evidence for a new resonance, which we refer to as B(5970), found simultaneously in the $B^0\\pi^+$ and $B^+\\pi^-$ mass distributions with a significance of 4.4 standard deviations. We further report the first study of resonances consistent with orbitally excited $B^{+}$ mesons and an updated measurement of the properties of orbitally excited $B^0$ and $B_s^0$ mesons. Using samples of approximately 8400 $B^{**0}$, 3300 $B^{**+}$, 1350 $B^{**0}_s$, 2600 $B(5970)^0$, and 1400 $B(5970)^+$ decays, we measure the masses and widths of all states, as well as the product of the relative production rate of $B_1$ and $B_2^*$ states times the branching fraction into a $B^{0,+}$ meson and a charged particle. Furthermore, we measure the branching fraction of the $B_{s2}^{*0} \\rightarrow B^{*+} K^-$ decay relative to the $B_{s2}^{*0} \\rightarrow B^{+} K^-$ decay, the production rate times the branching fraction of the B(5970) state relative to the $B_{2}^{*0,+}$ state, and th...

  4. Design study of a resonant Schottky pick-up for the Rare-RI Ring project

    Energy Technology Data Exchange (ETDEWEB)

    Suzaki, F., E-mail: suzaki@ribf.riken.jp [Department of Physics, Saitama University, Saitama 338-8570 (Japan); Zenihiro, J. [RIKEN Nishina Center, RIKEN, Wako, Saitama 351-0198 (Japan); Yamaguchi, T., E-mail: yamaguti@phy.saitama-u.ac.jp [Department of Physics, Saitama University, Saitama 338-8570 (Japan); Ozawa, A. [Institute of Physics, University of Tsukuba, Ibaraki 305-8571 (Japan); Uesaka, T.; Wakasugi, M.; Yamada, K.; Yamaguchi, Y. [RIKEN Nishina Center, RIKEN, Wako, Saitama 351-0198 (Japan)

    2013-12-15

    Highlights: • The heavy-ion storage ring project, the Rare-RI Ring, is ongoing at the RIKEN RI Beam Factory. • The Rare-RI Ring will enable precision isochronous mass spectrometry of r-process nuclei. • A resonant Schottky pick-up will be used for the precise tuning of isochronous optics of the storage ring. • Simulation results of 3D electromagnetic field calculations show a high sensitivity of stored single-ion detection. -- Abstract: The new heavy-ion storage ring project Rare-RI Ring at the RIKEN RI Beam Factory launched in 2012 aims at precision isochronous mass spectrometry for single ions of exotic nuclides. To precisely tune the storage-ring ion optical conditions to the isochronous field setting, Schottky noise pick-up technique will be employed. Pillbox-type resonant cavity, similar to the Schottky pick-up system successfully operating at the experimental storage ring ESR at GSI, is adopted for the pick-up probe. To determine the design values of the cavity, we systematically performed a simulation study of three-dimensional electromagnetic field calculations in the high frequency region. High shunt impedance obtained in the simulation will enable us to detect stored single ions with charge down to q≃15.

  5. Low-field nuclear magnetic resonance for the in vivo study of water content in trees

    Energy Technology Data Exchange (ETDEWEB)

    Yoder, Jacob, E-mail: jlyoder@lanl.gov [Inorganic, Isotope and Actinide Chemistry, Los Alamos National Laboratory, Los Alamos, New Mexico 87545 (United States); Malone, Michael W.; Espy, Michelle A. [Applied Modern Physics, Los Alamos National Laboratory, Los Alamos, New Mexico 87545 (United States); Sevanto, Sanna [Earth Systems Observations, Los Alamos National Laboratory, Los Alamos, New Mexico 87545 (United States)

    2014-09-15

    Nuclear magnetic resonance (NMR) and magnetic resonance imaging have long been used to study water content in plants. Approaches have been primarily based on systems using large magnetic fields (∼1 T) to obtain NMR signals with good signal-to-noise. This is because the NMR signal scales approximately with the magnetic field strength squared. However, there are also limits to this approach in terms of realistic physiological configuration or those imposed by the size and cost of the magnet. Here we have taken a different approach – keeping the magnetic field low to produce a very light and inexpensive system, suitable for bulk water measurements on trees less than 5 cm in diameter, which could easily be duplicated to measure on many trees or from multiple parts of the same tree. Using this system we have shown sensitivity to water content in trees and their cuttings and observed a diurnal signal variation in tree water content in a greenhouse. We also demonstrate that, with calibration and modeling of the thermal polarization, the system is reliable under significant temperature variation.

  6. Structural and dynamical properties of chlorinated hydrocarbons studied with resonant inelastic x-ray scattering

    Science.gov (United States)

    Bohinc, R.; Žitnik, M.; Bučar, K.; Kavčič, M.; Carniato, S.; Journel, L.; Guillemin, R.; Marchenko, T.; Kawerk, E.; Simon, M.; Cao, W.

    2016-04-01

    We present a theoretical and experimental study of resonant inelastic x-ray scattering on a large group of chlorinated hydrocarbons: CH3Cl, CH2Cl2, CHCl3, CCl4, CH3CH2Cl, ClCH2CH2Cl, CH3CHCl2, CH3CCl3, C2H2Cl2-iso, C2H2Cl2-cis, C2H2Cl2-trans, and C6H5Cl. Differences in structural and dynamical properties of the molecules generated by diverse chemical environments are observed in the measured Cl(Kα) spectral maps as well as in the Cl(K) total fluorescence yield spectra. The energy position, relative intensity, and the width of the Franck-Condon distribution of low-lying σ∗ and π∗ resonances are extracted by a fitting procedure taking into account the experimental broadening. The theoretical values obtained with the transition potential and Δ Kohn-Sham methods are in good agreement with the experimental parameters indicating subtle differences due to variations in the molecular structure.

  7. Study and design of the ion cyclotron resonance heating system for the stellarator Wendelstein 7-X

    Science.gov (United States)

    Ongena, J.; Messiaen, A.; Van Eester, D.; Schweer, B.; Dumortier, P.; Durodie, F.; Kazakov, Ye. O.; Louche, F.; Vervier, M.; Koch, R.; Krivska, A.; Lyssoivan, A.; Van Schoor, M.; Wauters, T.; Borsuk, V.; Neubauer, O.; Schmitz, O.; Offermans, G.; Altenburg, Y.; Baylard, C.; Birus, D.; Bozhenkov, S.; Hartmann, D. A.; Kallmeyer, J. P.; Renard, S.; Wolf, R. C.; Fülöp, T.

    2014-06-01

    The current status of the mechanical and electromagnetic design for the ICRF antenna system for W7-X is presented. Two antenna plugins are discussed: one consisting of a pair of straps with pre-matching to cover the first frequency band, 25-38 MHz, and a second one consisting of two short strap triplets to cover a frequency band around 76 MHz. This paper focusses on the two strap antenna for the lower frequency band. Power coupling of the antenna to a reference plasma profile is studied with the help of the codes TOPICA and Microwave Studio that deliver the scattering matrix needed for the optimization of the geometric parameters of the straps and antenna box. Radiation power spectra for different phasings of the two straps are obtained using the code ANTITER II and different heating scenario are discussed. The potential for heating, fast particle generation, and current drive is discussed. The problem of RF coupling through the plasma edge and of edge power deposition is summarized. Important elements of the complete ion cyclotron resonance heating system are discussed: a resonator circuit with tap feed to limit the maximum voltage in the system, and a decoupler to counterbalance the large mutual coupling between the 2 straps. The mechanical design highlights the challenges encountered with this antenna: adaptation to a large variety of plasma configurations, the limited space within the port to accommodate the necessary matching components and the watercooling needed for long pulse operation.

  8. Solvatochromism of 9,10-phenanthrenequinone: an electronic and resonance Raman spectroscopic study.

    Science.gov (United States)

    Ravi Kumar, Venkatraman; Rajkumar, Nagappan; Umapathy, Siva

    2015-01-14

    Solvent effects play a vital role in various chemical, physical, and biological processes. To gain a fundamental understanding of the solute-solvent interactions and their implications on the energy level re-ordering and structure, UV-VIS absorption, resonance Raman spectroscopic, and density functional theory calculation studies on 9,10-phenanthrenequinone (PQ) in different solvents of diverse solvent polarity has been carried out. The solvatochromic analysis of the absorption spectra of PQ in protic dipolar solvents suggests that the longest (1n-π(1)*; S1 state) and the shorter (1π-π(1)*; S2 state) wavelength band undergoes a hypsochromic and bathochromic shift due to intermolecular hydrogen bond weakening and strengthening, respectively. It also indicates that hydrogen bonding plays a major role in the differential solvation of the S2 state relative to the ground state. Raman excitation profiles of PQ (400-1800 cm(-1)) in various solvents followed their corresponding absorption spectra therefore the enhancements on resonant excitation are from single-state rather than mixed states. The hyperchromism of the longer wavelength band is attributed to intensity borrowing from the nearby allowed electronic transition through vibronic coupling. Computational calculation with C2ν symmetry constraint on the S2 state resulted in an imaginary frequency along the low-frequency out-of-plane torsional modes involving the C=O site and therefore, we hypothesize that this mode could be involved in the vibronic coupling.

  9. An Experimental Study of Nonlinear Standing Waves in Resonators with Numerical Comparison

    Science.gov (United States)

    Finkbeiner, Joshua R.; Raman, Ganesh; Li, Xiaofan; Steinetz, Bruce M.; Daniels, Christopher; Huff, Dennis (Technical Monitor)

    2002-01-01

    Lawrenson et. al. [Journal of the Acoustic Society of America, Nov. 1998] described the generation of shock-free high-amplitude pressure waves in closed cavities using large equipment and resonators to produce the reported effects. An attempt is made to generate shock-free high-amplitude pressure waves using relatively small resonators. Ambient air is used as the working fluid. A small cylindrical resonator is tested resulting in the lack of a shocked waveform while a larger model of the same shape produces shock waves. A small conical resonator produces shock-free pressure waves at resonance, but the amplitude of these waves is small. A larger cone resonator model produces shock-free pressure waves of higher amplitude. A large horn-cone resonator also produces shock-free high amplitude pressure waves, A numerical model is used to compare the experimental results to theoretical results. The effects of structural resonances on the production of shock-free high-amplitude pressure waves are discussed, especially concerning difficulties encountered when these resonances were in the frequency ranges of interest. Identifying features of a structural resonance are presented.

  10. The applicability and limitations of the geochemical models and tools used in simulating radionuclide behaviour in natural waters. Lessons learned from the Blind Predictive Modelling exercises performed in conjunction with Natural Analogue studies

    Energy Technology Data Exchange (ETDEWEB)

    Bruno, J.; Duro, L.; Grive, M. [QuantiSci SL, Parc Tecnologic del Valles (Spain)

    2001-07-01

    One of the key applications of Natural Analogue studies to the Performance Assessment (PA) of nuclear waste disposal has been the possibility to test the geochemical models and tools to be used in describing the migration of radionuclides in a future radioactive waste repository system. To this end, several geochemical modelling testing exercises (commonly denoted as Blind Predictive Modelling), have formed an integral part of Natural Analogue Studies over the last decade. Consequently, we thought that this is a timely occasion to make an evaluation of the experience gained and lessons learnt. We have reviewed, discussed and compared the results obtained from the Blind Prediction Modelling (BPM) exercises carried out within 7 Natural Analogue Studies: Oman, Pocos de Caldas, Cigar Lake, Maqarin, El Berrocal, Oklo and Palmottu. To make this comparison meaningful, we present the main geochemical characteristics of each site in order to highlight the most relevant mineralogical and hydrochemical differences. From the complete list of elements studied at all the investigated sites we have made a selection based on the relevance of a given element from a PA viewpoint and on the frequency this element has been included in the BPM exercises. The elements selected for discussion are: Sr, Ba, Sn, Pb, Se, Ni, Zn, REEs, Th and U. We have based our discussion on the results obtained from the speciation as well as solubility calculations. From the comparison of the results it is concluded that we can differentiate between three element categories: 1. Elements whose geochemical behaviour can be fairly well described by assuming solubility control exerted by pure solid phases of the given element (i.e. Th, U under reducing conditions and U in some sites under oxidising conditions); 2. Elements for which the association to major geochemical components of the system must be considered in order to explain their concentrations in groundwaters (i.e. Sr, Ba, Zn, Se, REEs and U under

  11. How Analogue Research Can Advance Descriptive Evaluation Theory: Understanding (and Improving) Stakeholder Dialogue

    Science.gov (United States)

    Campbell, Bernadette; Mark, Melvin M.

    2015-01-01

    Evaluation theories can be tested in various ways. One approach, the experimental analogue study, is described and illustrated in this article. The approach is presented as a method worthy to use in the pursuit of what Alkin and others have called descriptive evaluation theory. Drawing on analogue studies conducted by the first author, we…

  12. Electron spin resonance spectral study of PVC and XLPE insulation materials and their life time analysis

    Science.gov (United States)

    Morsy, M. A.; Shwehdi, M. H.

    2006-03-01

    Electron spin resonance (ESR) study is carried out to characterize thermal endurance of insulating materials used in power cable industry. The presented work provides ESR investigation and evaluation of widely used cable insulation materials, namely polyvinyl chloride (PVC) and cross-linked polyethylene (XLPE). The results confirm the fact that PVC is rapidly degrades than XLPE. The study also indicates that colorants and cable's manufacturing processes enhance the thermal resistance of the PVC. It also verifies the powerfulness and the importance of the ESR-testing of insulation materials compared to other tests assumed by International Electrotechnical Commission (IEC) Standard 216-procedure, e.g. weight loss (WL), electric strength (ES) or tensile strength (TS). The estimated thermal endurance parameters by ESR-method show that the other standard methods overestimate these parameters and produce less accurate thermal life time curves of cable insulation materials.

  13. ¹⁴N nuclear quadrupole resonance study of polymorphism in famotidine.

    Science.gov (United States)

    Luźnik, Janko; Pirnat, Janez; Jazbinšek, Vojko; Lavrič, Zoran; Žagar, Veselko; Srčič, Stane; Seliger, Janez; Trontelj, Zvonko

    2014-09-01

    (14)N nuclear quadrupole resonance (NQR) in two known polymorphs of famotidine was measured. At room temperature, seven quadrupolar sets of transition frequencies (ν(+), ν(-), and ν(0)) corresponding to seven different nitrogen sites in the crystal structure of each of the two polymorphs were found. This confirms the expected ability of NQR to distinguish polymorph B from its analog A. NQR can also measure their ratio in a solid mixture and in the final dosage form, that is, a tablet. The NQR frequencies, line shapes, and tentative assignation to all seven molecular (14)N atoms were obtained. Unravelment of these two entangled NQR spectra presents a valuable contribution to the NQR database and enables studies of some possible correlations therein. Moreover, nondestructive (14)N NQR studies of commercial famotidine tablets can reveal some details of the drug fabrication process connected with compression.

  14. Sympathetic Resonance Technology: scientific foundation and summary of biologic and clinical studies.

    Science.gov (United States)

    Rubik, Beverly

    2002-12-01

    Sympathetic Resonance Technology (SRT; Clarus Products, International, L.L.C., San Rafael, CA) is a novel technology used in consumer health care products to protect humans from the potentially harmful effects of stress. A summary of the previously unpublished studies on SRT, both basic and clinical, is presented. These studies collectively show that SRT mitigates the stress response for a variety of stressors such as chemical and electromagnetic stress in various biologic systems and multiple levels of organization, ranging from the molecular to the behavioral. A rudimentary model of how SRT may work at the level of the biofield, the endogenous electromagnetic field of the organism, is proposed. By interacting with key component frequencies in the biofield, SRT may stabilize the organism homeodynamically, thereby protecting it from the effects of stressful stimuli.

  15. The Photochemical Study of HSA and BSA with Resonance Light-Scattering and Fluorescence Spectra

    Institute of Scientific and Technical Information of China (English)

    2000-01-01

    The resonance light-scattering (RLS) of human serum albumin (HSA) and bovine serum albumin (BSA) is reported for the first time, and applied to study photochemical reaction of HSA and BSA. The fact of photocrosslinking self-association effect in HSA and BSA solutions is identified by the enhancement of RLS. The fluorescence quenching at about 350 nm and 700 nm proves that tryptophan (Trp) residues are one of the photochemical activity sites in HSA and BSA molecules. The Rayleigh scattering (RS) spectra of HSA and BSA that were neglected in fluorescence spectra before are found at about 296 nm, 592 nm and 888 nm for the first time, and are of adventageous to studying the aggregation of HSA or BSA. The possible photochemical reaction mechanism is also proposed.

  16. In vivo study of experimental pneumococcal meningitis using magnetic resonance imaging

    DEFF Research Database (Denmark)

    Brandt, C.T.; Simonsen, H.; Liptrot, Matthew George

    2008-01-01

    Background: Magnetic Resonance Imaging (MRI) methods were evaluated as a tool for the study of experimental meningitis. The identification and characterisation of pathophysiological parameters that vary during the course of the disease could be used as markers for future studies of new treatment...... blood-brain-barrier (BBB) permeability and to obtain a measure of cerebral and muscle perfusion. Clinical- and motor scores, bacterial counts in CSF and blood, and WBC counts in CSF were measured. Results: MR images and dMRI revealed the development of a highly significant increase in BBB permeability......-rat variation as the disease progressed, but without overall differences compared to uninfected rats (P > 0.05). Areas of well-'perfused' muscle decreased with the progression of infection indicative of septicaemia (P = 0.05). Conclusion: The evolution of bacterial meningitis was successfully followed in...

  17. A study of Feshbach resonances and the unitary limit in a model of strongly correlated nucleons

    CERN Document Server

    Mekjian, Aram Z

    2010-01-01

    A model of strongly interacting and correlated hadrons is developed. The interaction used contains a long range attraction and short range repulsive hard core. Using this interaction and various limiting situations of it, a study of the effect of bound states and Feshbach resonances is given. The limiting situations are a pure square well interaction, a delta-shell potential and a pure hard core potential. The limit of a pure hard core potential are compared with results for a spinless Bose and Fermi gas. The limit of many partial waves for a pure hard core interaction is also considered and result in expressions involving the hard core volume. This feature arises from a scaling relation similar to that for hard sphere scattering with diffractive corrections. The role of underlying isospin symmetries associated with the strong interaction of protons and neutrons in this two component model is investigated. Properties are studied with varying proton fraction. An analytic expression for the Beth Uhlenbeck conti...

  18. Visual activation in infants and young children studied by functional magnetic resonance imaging

    DEFF Research Database (Denmark)

    Born, Alfred Peter; Leth, H; Miranda Gimenez-Ricco, Maria Jo

    1998-01-01

    areas of signal decrease during visual stimulation in the occipital cortex (mean decrease 2.21%), contrary to the signal increase observed in the adult controls (mean increase 2.82%). This decrease may be due to a higher proportional increase in oxygen extraction compared with increase in cerebral blood...... it was restricted to the anterior and medial part of the calcarine sulcus in the younger infants. This may reflect a different functional organization of the young child's visual cortex or the on-going retinal development.......The purpose of this study was to determine whether visual stimulation in sleeping infants and young children can be examined by functional magnetic resonance imaging. We studied 17 children, aged 3 d to 48 mo, and three healthy adults. Visual stimulation was performed with 8-Hz flickering light...

  19. Is effective a prior multiparametric magnetic resonance scan in patients candidates to prostate biopsy? CAT Study.

    Science.gov (United States)

    Ramos Rodríguez, J R; Molinero Pérez, M; Herrera Imbroda, B; Domínguez Pinos, M D

    2016-01-01

    We carried out a critically appraised topic (CAT)-type study to determine whether the relevant scientific evidence supports the recommendation of doing a multiparametric magnetic resonance imaging study of the prostate in all patients who are candidates for prostate biopsy with the aim of improving the detection of clinically significant prostate cancer and stratifying patients to receive active surveillance or treatment. After a formal literature search and an analysis of the two most relevant articles it found, we reached the conclusion that, despite promising results that point to the potential usefulness of this approach, there is still not enough clear scientific evidence to endorse it categorically. Before this approach can be endorsed, we need evidence from well-designed prospective randomized trials using widely agreed upon criteria and including large numbers of patients at multiple centers.

  20. {sup 23}Na nuclear magnetic resonance study of the structure and dynamic of natrolite

    Energy Technology Data Exchange (ETDEWEB)

    Paczwa, Mateusz; Olszewski, Marcin; Sergeev, Nikolaj [Szczecin Univ. (Poland). Inst. of Physics; Sapiga, Aleksej A.; Sapiga, Aleksej V. [Taurida National V.I. Vernadsky Univ., Simferopol, Crimea (Ukraine)

    2015-07-01

    The temperature dependences of nuclear magnetic resonance (NMR) and magic angle spinning (MAS) NMR spectra of {sup 23}Na nuclei in natrolite (Na{sub 2}Al{sub 2}Si{sub 3}O{sub 10} . 2H{sub 2}O) have been studied. The temperature dependences of the spin-lattice relaxation times T{sub 1} in natrolite have also been studied. It has been shown that the spin-lattice relaxation of the {sup 23}Na is governed by the electric quadrupole interaction with the crystal electric field gradients modulated by translational motion of H{sub 2}O molecules in the natrolite pores. The dipolar interactions with paramagnetic impurities become significant as a relaxation mechanism of the {sup 23}Na nuclei only at low temperature (<270 K).

  1. Central effects of angiotensin II, its fragment and analogues.

    Science.gov (United States)

    Georgiev, V P; Klousha, V E; Petkov, V D; Markovska, V L; Svirskis, S V; Mountsinietse, R K; Anouans, Z E

    1984-01-01

    The effects of the octapeptide angiotensin II (AT II), its fragment Ile8 AT3-8 and the analogues Sar1 Ala8 AT II, Ala8 AT II and Ile8 AT II were studied with respect to: the level of biogenic amines (DA, 5-HT and their metabolites HVA and 5-HIAA) in the forebrain; the behaviour of the animals--haloperidol catalepsy, apomorphine stereotypy, unconditioned jumping reaction (UJR), convulsive threshold. Good correlation was found between the biochemical and behavioural effects. The fragment of AT II where phenylalanine is substituted at the C-terminal by Ile reduces the haloperidol-increased content of HVA, potentiates apomorphine stereotypy and reduces catalepsy, whereas the AT II analogues (where the C-terminal phenylalanine is substituted by Ala, and the N-terminal--by Sar) potentiate the effect of haloperidol increasing the HVA content, reduce apomorphine stereotypy and potentiate catalepsy; saralasine independently applied induces brief catalepsy; AT II, its fragment and analogues inhibit UJR, in combination with amphetamine and PTZ this effect becomes deeper; the duration of hexobarbital sleep is increased. The peptides investigated increase the convulsive threshold. The results show that the hexapeptide fragment has preserved the effects of AT II, whereas in the analogues (with changed C- and N-terminals) they are changed. The results obtained may be explained with the modulating influence of AT II-receptors on the DA-ergic receptors in the brain structures with which AT II and its fragment and analogues enter in contact.

  2. Engineering of insulin receptor isoform-selective insulin analogues.

    Directory of Open Access Journals (Sweden)

    Tine Glendorf

    Full Text Available BACKGROUND: The insulin receptor (IR exists in two isoforms, A and B, and the isoform expression pattern is tissue-specific. The C-terminus of the insulin B chain is important for receptor binding and has been shown to contact the IR just adjacent to the region where the A and B isoforms differ. The aim of this study was to investigate the importance of the C-terminus of the B chain in IR isoform binding in order to explore the possibility of engineering tissue-specific/liver-specific insulin analogues. METHODOLOGY/PRINCIPAL FINDINGS: Insulin analogue libraries were constructed by total amino acid scanning mutagenesis. The relative binding affinities for the A and B isoform of the IR were determined by competition assays using scintillation proximity assay technology. Structural information was obtained by X-ray crystallography. Introduction of B25A or B25N mutations resulted in analogues with a 2-fold preference for the B compared to the A isoform, whereas the opposite was observed with a B25Y substitution. An acidic amino acid residue at position B27 caused an additional 2-fold selective increase in affinity for the receptor B isoform for analogues bearing a B25N mutation. Furthermore, the combination of B25H with either B27D or B27E also resulted in B isoform-preferential analogues (2-fold preference even though the corresponding single mutation analogues displayed no differences in relative isoform binding affinity. CONCLUSIONS/SIGNIFICANCE: We have discovered a new class of IR isoform-selective insulin analogues with 2-4-fold differences in relative binding affinities for either the A or the B isoform of the IR compared to human insulin. Our results demonstrate that a mutation at position B25 alone or in combination with a mutation at position B27 in the insulin molecule confers IR isoform selectivity. Isoform-preferential analogues may provide new opportunities for developing insulin analogues with improved clinical benefits.

  3. A femtosecond transient absorption spectroscopic study on a carbonyl-containing carotenoid analogue, 2-(all-trans-retinylidene)-indan-1,3-dione

    Science.gov (United States)

    Kusumoto, Toshiyuki; Kosumi, Daisuke; Uragami, Chiasa; Frank, Harry A.; Birge, Robert R.; Cogdell, Richard J.; Hashimoto, Hideki

    2011-01-01

    The photophysical properties of a carbonyl-containing carotenoid analogue in an s-cis configuration, relative to the conjugated π system, 2-(all-trans-retinylidene)-indan-1,3-dione (C20Ind), were investigated by femtosecond time-resolved spectroscopy in various solvents. The lifetime of the optically forbidden S1 state of C20Ind becomes long as solvent polarity increases. This trend is completely opposite to the situation of S1-ICT dynamics of carbonyl-containing carotenoids, such as peridinin and fucoxanthin. Excitation energy dependence of the transient absorption measurements shows that the transient absorption spectra in non-polar solvents were originated from two distinct transient species, while those in polar and protic solvents are due to a single transient species. By referring to the results of MNDO-PSDCI (modified neglect of differential overlap with partial single- and double-configuration interaction) calculations, we conclude: (1) In polar and protic solvents, the S1 state is generated following excitation up to the S2 state; (2) In non-polar solvents, however, both the S1 and 1nπ* states are generated; and (3) C20Ind does not generate the S1-ICT state, despite the fact that it has two conjugated carbonyl groups. PMID:21361262

  4. Design and synthesis of biotin analogues reversibly binding with streptavidin.

    Science.gov (United States)

    Yamamoto, Tomohiro; Aoki, Kiyoshi; Sugiyama, Akira; Doi, Hirofumi; Kodama, Tatsuhiko; Shimizu, Yohei; Kanai, Motomu

    2015-04-01

    Two new biotin analogues, biotin carbonate 5 and biotin carbamate 6, have been synthesized. These molecules were designed to reversibly bind with streptavidin by replacing the hydrogen-bond donor NH group(s) of biotin's cyclic urea moiety with oxygen. Biotin carbonate 5 was synthesized from L-arabinose (7), which furnishes the desired stereochemistry at the 3,4-cis-dihydroxy groups, in 11% overall yield (over 10 steps). Synthesis of biotin carbamate 6 was accomplished from L-cysteine-derived chiral aldehyde 33 in 11% overall yield (over 7 steps). Surface plasmon resonance analysis of water-soluble biotin carbonate analogue 46 and biotin carbamate analogue 47 revealed that KD values of these compounds for binding to streptavidin were 6.7×10(-6)  M and 1.7×10(-10)  M, respectively. These values were remarkably greater than that of biotin (KD =10(-15)  M), and thus indicate the importance of the nitrogen atoms for the strong binding between biotin and streptavidin.

  5. Love-related changes in the brain: A resting-state functional magnetic resonance imaging study

    Directory of Open Access Journals (Sweden)

    Hongwen eSong

    2015-02-01

    Full Text Available Romantic love is a motivational state associated with a desire to enter or maintain a close relationship with a specific other person. Studies with functional magnetic resonance imaging (fMRI have found activation increases in brain regions involved in processing of reward, emotion, motivation when romantic lovers view photographs of their partners. However, not much is known on whether romantic love affects the brain’s functional architecture during rest. In the present study, resting state functional magnetic resonance imaging (rsfMRI data was collected to compare the regional homogeneity (ReHo and functional connectivity (FC across a lover group (LG, N=34, currently intensely in love, ended-love group (ELG, N=34, romantic relationship ended recently, and single group (SG, N=32, never fallen in love.The results showed that:1 ReHo of the left dorsal anterior cingulate cortex (dACC was significantly increased in the LG (in comparison to the ELG and the SG; 2 ReHo of the left dACC was positively correlated with length of time in love in the LG, and negatively correlated with the lovelorn duration since breakup in the ELG; 3 functional connectivity (FC within the reward, motivation, and emotion network (dACC, insula, caudate, amygdala and nucleus accumbens and the social cognition network (temporo-parietal junction (TPJ, posterior cingulate cortex (PCC, medial prefrontal cortex (MPFC, inferior parietal, precuneus and temporal lobe was significantly increased in the LG (in comparison to the ELG and SG; 4 in most regions within both networks FC was positively correlated with the love duration in the LG but negatively correlated with the lovelorn duration in the ELG. This study provides first empirical evidence of love-related alterations of brain functional architecture. The results shed light on the underlying neural mechanisms of romantic love, and demonstrate the possibility of applying a resting state approach for investigating romantic love.

  6. Radiation Dosimetry Study in Dental Enamel of Human Tooth Using Electron Paramagnetic Resonance

    Science.gov (United States)

    De, Tania; Romanyukha, Alex; Pass, Barry; Misra, Prabhakar

    2009-07-01

    Electron paramagnetic resonance (EPR) dosimetry of tooth enamel is used for individual dose reconstruction following radiation accidents. The purpose of this study is to develop a rapid, minimally invasive technique of obtaining a sample of dental enamel small enough to not disturb the structure and functionality of a tooth and to improve the sensitivity of the spectral signals using X-band (9.4 GHz) and Q-band (34 GHz) EPR technique. In this study EPR measurements in X-band were performed on 100 mg isotropic powdered enamel samples and Q-band was performed on 4 mg, 1×1×3 mm enamel biopsy samples. All samples were obtained from discarded teeth collected during normal dental treatment. To study the variation of the Radiation-Induced Signal (RIS) at different orientations in the applied magnetic field, samples were placed in the resonance cavity for Q-band EPR. X-band EPR measurements were performed on 100 mg isotropic powdered enamel samples. In X-band spectra, the RIS is distinct from the "native" radiation-independent signal only for doses >0.5 Gy. Q-band, however, resolves the RIS and "native" signals and improves sensitivity by a factor of 20, enabling measurements in 2-4 mg tooth enamel samples, as compared to 100 mg for X-band. The estimated lower limit of Q-band dose measurement is 0.5 Gy. Q-band EPR enamel dosimetry results in greater sensitivity and smaller sample size through enhanced spectral resolution. Thus, this can be a valuable technique for population triage in the event of detonation of a radiation dispersal device ("dirty" bomb) or other radiation event with massive casualties. Further, the small 4 mg samples can be obtained by a minimally-invasive biopsy technique.

  7. Maternal smoking during pregnancy and fetal organ growth: a magnetic resonance imaging study.

    Directory of Open Access Journals (Sweden)

    Devasuda Anblagan

    Full Text Available OBJECTIVE: To study whether maternal cigarette smoking during pregnancy is associated with alterations in the growth of fetal lungs, kidneys, liver, brain, and placenta. DESIGN: A case-control study, with operators performing the image analysis blinded. SETTING: Study performed on a research-dedicated magnetic resonance imaging (MRI scanner (1.5 T with participants recruited from a large teaching hospital in the United Kingdom. PARTICIPANTS: A total of 26 pregnant women (13 current smokers, 13 non smokers were recruited; 18 women (10 current smokers, 8 nonsmokers returned for the second scan later in their pregnancy. METHODS: Each fetus was scanned with MRI at 22-27 weeks and 33-38 weeks gestational age (GA. MAIN OUTCOME MEASURES: Images obtained with MRI were used to measure volumes of the fetal brain, kidneys, lungs, liver and overall fetal size, as well as placental volumes. RESULTS: Exposed fetuses showed lower brain volumes, kidney volumes, and total fetal volumes, with this effect being greater at visit 2 than at visit 1 for brain and kidney volumes, and greater at visit 1 than at visit 2 for total fetal volume. Exposed fetuses also demonstrated lower lung volume and placental volume, and this effect was similar at both visits. No difference was found between the exposed and nonexposed fetuses with regards to liver volume. CONCLUSION: Magnetic resonance imaging has been used to show that maternal smoking is associated with reduced growth of fetal brain, lung and kidney; this effect persists even when the volumes are corrected for maternal education, gestational age, and fetal sex. As expected, the fetuses exposed to maternal smoking are smaller in size. Similarly, placental volumes are smaller in smoking versus nonsmoking pregnant women.

  8. Study on A Control Method of PAPF for Resonance Damping and Harmonics Compensation in Power System

    DEFF Research Database (Denmark)

    Zhou, Fang; Wu, Longhui; Chen, Zhe

    2009-01-01

    In power system, capacitors are widely used to compensate reactive power, which generally cause resonance problems in harmonic distorted network. In this paper, A method of using a parallel active power filter (PAPF) to damp the resonances is proposed. The proposed method is compound with traditi......In power system, capacitors are widely used to compensate reactive power, which generally cause resonance problems in harmonic distorted network. In this paper, A method of using a parallel active power filter (PAPF) to damp the resonances is proposed. The proposed method is compound...

  9. Microwave broadband permittivity measurement with a multimode helical resonator for studying catalysts

    Science.gov (United States)

    Roussy, Georges; Thiebaut, Jean-Marie; Ename-Obiang, Francis; Marchal, Eric

    2001-04-01

    The authors present a resonant permittivity measurement method which works over a large microwave frequency domain, with a very small volume sample of dielectric material. The cell is a helical resonator having many modes of resonance. The shifts of resonance frequency and Q-factors are better interpreted with a bilinear function which depends on the complex permittivity of the material than by applying the classical perturbation formula. Results concerning two different catalysts which are used in the coupling oxidation methane reaction are given as a function of the temperature and the frequency to illustrate the correlation of both data sets and the differences in catalytic mechanisms.

  10. Study of tunable resonances in laser beam divergence and beam deflection

    CERN Document Server

    Kohazi-Kis, A; Gorbe, M; Nagy, P

    2012-01-01

    New, fundamental resonant properties of laser resonators are theoretically predicted and experimentally demonstrated. These resonances occur either in the time dependence of the beam width and that of beam radius of curvature of the wavefront or in the time dependent pointing and position stability of the output light beam of a laser resonator. The resonant frequency can be tuned continuously from zero to the round-trip frequency in the first case; and from zero to the half of the round-trip frequency in the second case, by for example, moving one of the mirrors of the resonator. In both cases besides a resonant frequency its complementary frequency to the round-trip frequency is also resonant, and their shifted frequencies by multiples of the round-trip frequency are also resonant. In our experimental demonstration we measured the radiofrequency noise spectrum of the output laser beam, that was partially blocked by a knife-edge. We observed increased noise at the theoretically predicted frequencies. Similar ...

  11. Nuclear magnetic resonance studies of quadrupolar nuclei and dipolar field effects

    Energy Technology Data Exchange (ETDEWEB)

    Urban, Jeffry Todd

    2004-12-21

    Experimental and theoretical research conducted in two areas in the field of nuclear magnetic resonance (NMR) spectroscopy is presented: (1) studies of the coherent quantum-mechanical control of the angular momentum dynamics of quadrupolar (spin I > 1/2) nuclei and its application to the determination of molecular structure; and (2) applications of the long-range nuclear dipolar field to novel NMR detection methodologies.The dissertation is organized into six chapters. The first two chapters and associated appendices are intended to be pedagogical and include an introduction to the quantum mechanical theory of pulsed NMR spectroscopy and the time dependent theory of quantum mechanics. The third chapter describes investigations of the solid-state multiple-quantum magic angle spinning (MQMAS) NMR experiment applied to I = 5/2 quadrupolar nuclei. This work reports the use of rotary resonance-matched radiofrequency irradiation for sensitivity enhancement of the I = 5/2 MQMAS experiment. These experiments exhibited certain selective line narrowing effects which were investigated theoretically.The fourth chapter extends the discussion of multiple quantum spectroscopy of quadrupolar nuclei to a mostly theoretical study of the feasibility of enhancing the resolution of nitrogen-14 NMR of large biomolecules in solution via double-quantum spectroscopy. The fifth chapter continues to extend the principles of multiple quantum NMR spectroscopy of quadrupolar nuclei to make analogies between experiments in NMR/nuclear quadrupolar resonance (NQR) and experiments in atomic/molecular optics (AMO). These analogies are made through the Hamiltonian and density operator formalism of angular momentum dynamics in the presence of electric and magnetic fields.The sixth chapter investigates the use of the macroscopic nuclear dipolar field to encode the NMR spectrum of an analyte nucleus indirectly in the magnetization of a sensor nucleus. This technique could potentially serve as an

  12. Acute ischaemic brain lesions in intracerebral haemorrhage: multicentre cross-sectional magnetic resonance imaging study.

    Science.gov (United States)

    Gregoire, Simone M; Charidimou, Andreas; Gadapa, Naveen; Dolan, Eamon; Antoun, Nagui; Peeters, Andre; Vandermeeren, Yves; Laloux, Patrice; Baron, Jean-Claude; Jäger, Hans R; Werring, David J

    2011-08-01

    Subclinical acute ischaemic lesions on brain magnetic resonance imaging have recently been described in spontaneous intracerebral haemorrhage, and may be important to understand pathophysiology and guide treatment. The underlying mechanisms are uncertain. We tested the hypothesis that ischaemic lesions are related to magnetic resonance imaging markers of the severity and type of small-vessel disease (hypertensive arteriopathy or cerebral amyloid angiopathy) in a multicentre, cross-sectional study. We studied consecutive patients with intracerebral haemorrhage from four specialist stroke centres, and age-matched stroke service referrals without intracerebral haemorrhage. Acute ischaemic lesions were assessed on magnetic resonance imaging (imaging. White matter changes and cerebral microbleeds were rated with validated scales. We investigated associations between diffusion-weighted imaging lesions, clinical and radiological characteristics. We included 114 patients with intracerebral haemorrhage (39 with clinically probable cerebral amyloid angiopathy) and 47 age-matched controls. The prevalence of diffusion-weighted imaging lesions was 9/39 (23%) in probable cerebral amyloid angiopathy-related intracerebral haemorrhage versus 6/75 (8%) in the remaining patients with intracerebral haemorrhage (P = 0.024); no diffusion-weighted imaging lesions were found in controls. Diffusion-weighted imaging lesions were mainly cortical and were associated with mean white matter change score (odds ratio 1.14 per unit increase, 95% confidence interval 1.02-1.28, P = 0.024) and the presence of strictly lobar cerebral microbleeds (odds ratio 3.85, 95% confidence interval 1.15-12.93, P = 0.029). Acute, subclinical ischaemic brain lesions are frequent but previously underestimated after intracerebral haemorrhage, and are three times more common in cerebral amyloid angiopathy-related intracerebral haemorrhage than in other intracerebral haemorrhage types. Ischaemic brain lesions are

  13. Nuclear magnetic resonance studies of quadrupolar nuclei and dipolar field effects

    Energy Technology Data Exchange (ETDEWEB)

    Urban, Jeffry Todd [Univ. of California, Berkeley, CA (United States)

    2004-01-01

    Experimental and theoretical research conducted in two areas in the field of nuclear magnetic resonance (NMR) spectroscopy is presented: (1) studies of the coherent quantum-mechanical control of the angular momentum dynamics of quadrupolar (spin I > 1/2) nuclei and its application to the determination of molecular structure; and (2) applications of the long-range nuclear dipolar field to novel NMR detection methodologies.The dissertation is organized into six chapters. The first two chapters and associated appendices are intended to be pedagogical and include an introduction to the quantum mechanical theory of pulsed NMR spectroscopy and the time dependent theory of quantum mechanics. The third chapter describes investigations of the solid-state multiple-quantum magic angle spinning (MQMAS) NMR experiment applied to I = 5/2 quadrupolar nuclei. This work reports the use of rotary resonance-matched radiofrequency irradiation for sensitivity enhancement of the I = 5/2 MQMAS experiment. These experiments exhibited certain selective line narrowing effects which were investigated theoretically.The fourth chapter extends the discussion of multiple quantum spectroscopy of quadrupolar nuclei to a mostly theoretical study of the feasibility of enhancing the resolution of nitrogen-14 NMR of large biomolecules in solution via double-quantum spectroscopy. The fifth chapter continues to extend the principles of multiple quantum NMR spectroscopy of quadrupolar nuclei to make analogies between experiments in NMR/nuclear quadrupolar resonance (NQR) and experiments in atomic/molecular optics (AMO). These analogies are made through the Hamiltonian and density operator formalism of angular momentum dynamics in the presence of electric and magnetic fields.The sixth chapter investigates the use of the macroscopic nuclear dipolar field to encode the NMR spectrum of an analyte nucleus indirectly in the magnetization of a sensor nucleus. This technique could potentially serve as an

  14. Synthesis of daidzin analogues as potential agents for alcohol abuse.

    Science.gov (United States)

    Gao, Guang-Yao; Li, Dian-Jun; Keung, Wing Ming

    2003-09-01

    Daidzin, the active principle of an herbal remedy for 'alcohol addiction', has been shown to reduce alcohol consumption in all laboratory animals tested to date. Correlation studies using structural analogues of daidzin suggests that it acts by raising the monoamine oxidase (MAO)/mitochondrial aldehyde dehydrogenase (ALDH-2) activity ratio (J. Med. Chem. 2000, 43, 4169). Structure-activity relationship (SAR) studies on the 7-O-substituted analogues of daidzin have revealed structural features important for ALDH-2 and MAO inhibition (J. Med. Chem. 2001, 44, 3320). We here evaluated effects of substitutions at 2, 5, 6, 8, 3' and 4' positions of daidzin on its potencies for ALDH-2 and MAO inhibition. Results show that analogues with 4'-substituents that are small, polar and with hydrogen bonding capacities are most potent ALDH-2 inhibitors, whereas those that are non-polar and with electron withdrawing capacities are potent MAO inhibitors. Analogues with a 5-OH group are less potent ALDH-2 inhibitors but are more potent MAO inhibitors. All the 2-, 6-, 8- and 3'-substituted analogues tested so far do not inhibit ALDH-2 and/or have decreased potencies for MAO inhibition. This, together with the results obtained from previous studies, suggests that a potent antidipsotropic analogue would be a 4',7-disubstituted isoflavone. The 4'-substituent should be small, polar, and with hydrogen bonding capacities such as, -OH and -NH(2); whereas the 7-substituent should be a straight-chain alkyl with a terminal polar function such as -(CH(2))(n)-OH with 2 or =4.

  15. Vibrational resonance: a study with high-order word-series averaging

    CERN Document Server

    Murua, Ander

    2016-01-01

    We study a model problem describing vibrational resonance by means of a high-order averaging technique based on so-called word series. With the tech- nique applied here, the tasks of constructing the averaged system and the associ- ated change of variables are divided into two parts. It is first necessary to build recursively a set of so-called word basis functions and, after that, all the required manipulations involve only scalar coefficients that are computed by means of sim- ple recursions. As distinct from the situation with other approaches, with word- series, high-order averaged systems may be derived without having to compute the associated change of variables. In the system considered here, the construction of high-order averaged systems makes it possible to obtain very precise approxima- tions to the true dynamics.

  16. Preliminary study for precision dosimetry using electron paramagnetic resonance (EPR) in radiotherapy applications

    Energy Technology Data Exchange (ETDEWEB)

    Shehzadi, N. N.; Kim, I. J.; Yi, C. Y. [Center for Ionizing Radiation, Korea Research for Standards and Science, Daejeon (Korea, Republic of)

    2015-10-15

    EPR (Electron paramagnetic resonance) dosimetry for radiotherapy dose range (1-10 Gy) is still being established.Alanine is an important material for EPR dosimetry because in terms of density and radiation absorption properties, it is water equivalent. High repeatability and high reproducibility of alanine spectrum measurement makes it possible to estimate the irradiation dose accurately. This baseline study has been carried out to establish precision EPR dosimetry in therapeutic photon range. For that purpose, an EPR dosimetry system has been setup and repeatability as well as reproducibility of measurements using alanine dosimeter have been evaluated. Effect of anisotropy of alanine dosimeter in spectrometer cavity has also been observed. EPR dosimetry system is set up at KRISS. It is found that reproducibility of the system at therapeutic photon range is 1.5 % - 6.6 %.

  17. Electron spin resonance spectroscopy for the study of nanomaterial-mediated generation of reactive oxygen species

    Directory of Open Access Journals (Sweden)

    Weiwei He

    2014-03-01

    Full Text Available Many of the biological applications and effects of nanomaterials are attributed to their ability to facilitate the generation of reactive oxygen species (ROS. Electron spin resonance (ESR spectroscopy is a direct and reliable method to identify and quantify free radicals in both chemical and biological environments. In this review, we discuss the use of ESR spectroscopy to study ROS generation mediated by nanomaterials, which have various applications in biological, chemical, and materials science. In addition to introducing the theory of ESR, we present some modifications of the method such as spin trapping and spin labeling, which ultimately aid in the detection of short-lived free radicals. The capability of metal nanoparticles in mediating ROS generation and the related mechanisms are also presented.

  18. Lanthanum-139 nuclear magnetic resonance studies of polyaminocarboxylate-lanthanum complexes in aqueous solution

    Science.gov (United States)

    Geraldes, Carlos F. G. C.; Dean Sherry, A.

    Several complexes of La(III) with aminocarboxylate and polyaminocarboxylate ligands in aqueous solution have been studied using 139La chemical-shift and linewidth measurements. The ligand-induced shifts of the 139La NMR resonance were found to depend, at least to first order, on additive substituent contributions, and were empirically related to the number and type of coordinated oxygen and nitrogen atoms. A previously proposed relationship between the number of coordinated carboxylate oxygen atoms and observed 139La shifts does not seem to hold for the polyaminocarboxylate complexes and we propose a new empirical relationship which allows an accurate prediction of the number and types of ligand donors in these systems. The 139La linewidths also provide qualitative information about the symmetry of each La 3+ chelate. The results show that 139La NMR can be a powerful technique for elucidating the structure and dynamics of lanthanide complexes in solution.

  19. A sup 1 H nuclear magnetic resonance study of structural and organisational changes in the cell

    CERN Document Server

    Tunnah, S K

    2000-01-01

    Increasing importance is being placed on understanding the role of membrane lipids in many different areas of biochemistry. It is of interest to determine what interactions may occur between membrane lipids and drug species. Furthermore, an increasing body of evidence suggests that membrane lipids are involved in the pathology of numerous diseases such as rheumatoid arthritis, cancer and HIV. Clearly, the more information available on the mechanisms involved in diseases, the greater the potential for identifying a cure or even a prevention. sup 1 H nuclear magnetic resonance (NMR) spectroscopy was used to study the alterations in membrane lipid organisation and structure in intact, viable cultured cells. Changes in the sup 1 H NMR spectra and the spin-lattice relaxation measurements of the human K562 and the rat FRTL-5 cell lines were observed on the addition of the fatty acid species: triolein, evening primrose oil, arachidonic acid and ITF 1779. Results indicate that the membrane lipids are reorganised to a...

  20. The blood flow in the posterior communicant artery. Angiographic study by using magnetic resonance

    CERN Document Server

    Portela, L A P

    1995-01-01

    did not change the direction of flow present, in the circumstances of this study. The arterial circle of Willis is the most important collateral pathway for the cerebral vessels when one the afferents is occluded. Its normal function, without vascular compromise, has been considered in conflicting ways in the literature. For centuries after its description by Thomas Willis in 1664 it was considered a flow equalizer, with free admixture of blood within it. Since the beginning of this century the dominant view is one of a potential value only, with null effective flow in the communicating arteries. The premise is included in different experimental models. Alternatively, it was considered that the normal direction of flow is antero-posterior, from carotid to posterior cerebral, since carotid flow is greater. Using phase-contrast magnetic resonance angiography, a non-invasive qualitative method, it was found in 40 patients without morphological brain abnormality and in 10 healthy volunteers that flow can be seen ...