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Sample records for l11-rrna58nt-thiostrepton ternary complexes

  1. Release of DNA binary complexes from the ternary complexes by carboxymethyl poly(L-histidine).

    Science.gov (United States)

    Asayama, Shoichiro; Sudo, Miyuki; Kawakami, Hiroyoshi

    2009-01-01

    The DNA ternary complexes with carboxymethyl poly(L-histidine) (CM-PLH) and poly(ethylenimine) (PEI) have released the DNA binary complexes with PEI by the protonation of CM-PLH at endosomal/lysosomal pH. The dissociation of the CM-PLH from the CM-PLH/PEI/DNA ternary complexes is proved by the fluorescence resonance energy transfer (FRET) analysis between the CM-PLH and PEI. The resulting PEI/DNA binary complexes easily released DNA, as compared with the CM-PLH/PEI/DNA ternary complexes, which was examined by competitive exchange with dextran sulfate. The release of the DNA binary complexes from the ternary complexes is promising mechanism for higher transfection activity by the CM-PLH/PEI/DNA ternary complexes.

  2. Formation Equilibria of Ternary Metal Complexes with Citric Acid and Glutamine (Alanine) in Aqueous Solution

    Institute of Scientific and Technical Information of China (English)

    王进平; 牛春吉; 杨魁跃; 倪嘉缵

    2004-01-01

    The species and their formation constants in the ternary systems were obtained by the Scogs2 software from potentiometric titration data. The Comics software was used to calculate the distribution of species in the ternary systems. MLXH, MLXH2 and MLXH3 are the common species in these systems. The coordination behaviors of the rare earths are very similar and their stability is closely matched. The ternary rare earth complexes are more stable than the corresponding ternary complexes of calcium. The ternary zinc complex with glutamine as the secondary ligand is more stable than the corresponding complexes of rare earths, but the ternary complex with alanine as the secondary ligand shows an inverse trend. The distributions of species in the ternary systems vary with pH changing. A prediction can be made that exogenous rare earths can affect the species of Ca and Zn in human body.

  3. [Synthesis, characterization and luminescence properties of novel beta-diketone and Eu(III) ternary complex].

    Science.gov (United States)

    Cheng, Guo; Wei, Chang-Ping; Ren, Xiao-Ming; Wang, He; Wei, Wen-Tao

    2011-09-01

    The novel beta-diketone 1-(4-bromophenyl)-3-phenylpropane-1, 3-dione (L) was synthesized at room temperature by classical Claisen condensation reaction. With the beta-diketone L as the first ligand and phen as the secondary ligand, and a new rare-earth Eu (III) ternary complex was prepared. The ligand L and ternary complex were characterized by elemental analysis, IR spectra, UV spectra and fluorescence spectra. IR spectra indicated that: the novel ligand L contained the structure of beta-diketone, where the content of enol was high; the Eu3+ ion in the ternary complex was coordinated with six oxygen atoms of three L ligands and two nitrogen atoms of the second ligand phen. UV spectra showed that the main absorption was from the first ligand L in the Eu (III) ternary complex. The excitation and emission spectra of the ternary complex were measured and investigated. Fluorescence spectra demonstrated that the ternary complex could emit characteristic fluorescence of rare earth Eu3+ ion and the strongest emission band was narrow which was attributed to the 5 D0 --> 7 F2 transitions of the 4f electrons of the central Eu3+ ions. So, the new Eu(III) ternary complex is an excellent red-emitter which would be regarded as a valuable material with bright red fluorescence because it presents good monochromaticity.

  4. Ultrafast Charge Recombination Dynamics in Ternary Electron Donor-Acceptor Complexes: (Benzene)2-Tetracyanoethylene Complexes.

    Science.gov (United States)

    Chiu, Chih-Chung; Hung, Chih-Chang; Cheng, Po-Yuan

    2016-12-08

    The charge-transfer (CT) state relaxation dynamics of the binary (1:1) and ternary (2:1) benzene/tetracyanoethylene (BZ/TCNE) complexes are reported. Steady-state and ultrafast time-resolved broadband fluorescence (TRFL) spectra of TCNE dissolved in a series of BZ/CCl4 mixed solvents are measured to elucidate the spectroscopic properties of the BZ/TCNE complexes and their CT-state relaxation dynamics. Both steady-state and TRFL spectra exhibit marked BZ concentration dependences, which can be attributed to the formation of two types of 2:1 complexes in the ground and excited states. By combining with the density functional theory (DFT) calculations, it was concluded that the BZ concentration dependence of the absorption spectra is mainly due to the formation and excitation of the sandwich-type 2:1 ternary complexes, whereas the changes in fluorescence spectra at high BZ concentrations are due to the formation of the asymmetric-type 2:1 ternary complex CT1 state. A unified mechanism involving both direct excitation and secondary formation of the 2:1 complexes CT states are proposed to account for the observations. The equilibrium charge recombination (CR) time constant of the 1:1 CT1 state is determined to be ∼150 ps in CCl4, whereas that of the 2:1 DDA-type CT1 state becomes ∼70 ps in 10% BZ/CCl4 and ∼34 ps in pure BZ. The CR rates and the CT1-S0 energy gap of these complexes in different solvents exhibit a correlation conforming to the Marcus inverted region. It is concluded that partial charge resonance occurring between the two adjacent BZs in the asymmetric-type 2:1 CT1-state reduces the CR reaction exothermicity and increases the CR rate.

  5. Structural and thermal characterization of ternary complexes of piroxicam and alanine with transition metals: Uranyl binary and ternary complexes of piroxicam. Spectroscopic characterization and properties of metal complexes

    Science.gov (United States)

    Mohamed, Gehad G.

    2005-12-01

    Ternary Fe(III), Co(II), Ni(II), Cu(II), Zn(II) and UO 2(II) complexes with piroxicam (Pir) drug (H 2L 1) and dl-alanine (Ala) (HL 2) and also the binary UO 2(II) complex with Pir were studied. The structures of the complexes were elucidated using elemental, IR, molar conductance, magnetic moment, diffused reflectance and thermal analyses. The UO 2(II) binary complex was isolated in 1:2 ratio with the formula [UO 2(H 2L) 2](NO 3) 2. The ternary complexes were isolated in 1:1:1 (M:H 2L 1:L 2) ratios. The solid complexes were isolated in the general formulae [M(H 2L)(L 2)(Cl) n(H 2O) m]· yH 2O (M = Fe(III) ( n = 2, m = 0, y = 1), Co(II) ( n = 1, m = 1, y = 2) and Ni(II) ( n = 1, m = 1, y = 0)); [M(H 2L)(L 2)](X) z· yH 2O (M = Cu(II) (X = AcO, z = 1, y = 0), Zn(II) (X = AcO, z = 1, y = 3) and UO 2(II) (X = NO 3, z = 1, y = 2)). Pir behaves as a neutral bidentate ligand coordinated to the metal ions via the pyridine-N and carbonyl-O groups, while Ala behaves as a uninegatively bidentate ligand coordinated to the metal ions via the deprotonated carboxylate-O and amino-N. The magnetic and reflectance spectral data show that the complexes have octahedral geometry except Cu(II) and Zn(II) complexes have tetrahedral structures. The thermal decomposition of the complexes was discussed in relation to structure, and the thermodynamic parameters of the decomposition stages were evaluated.

  6. Crystallization, data collection and processing of the chymotrypsin–BTCI–trypsin ternary complex

    Energy Technology Data Exchange (ETDEWEB)

    Esteves, Gisele Ferreira; Teles, Rozeni Chagas Lima; Cavalcante, Nayara Silva; Neves, David; Ventura, Manuel Mateus [Laboratório de Biofísica, Instituto de Ciências Biológicas, Universidade de Brasília, 70910-900 Brasília-DF (Brazil); Barbosa, João Alexandre Ribeiro Gonçalves, E-mail: joao@lnls.br [Center for Structural Molecular Biology (CeBiME), Brazilian Synchrotron Light Laboratory (LNLS), CP 6192, 13083-970 Campinas-SP (Brazil); Freitas, Sonia Maria de, E-mail: joao@lnls.br [Laboratório de Biofísica, Instituto de Ciências Biológicas, Universidade de Brasília, 70910-900 Brasília-DF (Brazil)

    2007-12-01

    A ternary complex of the proteinase inhibitor (BTCI) with trypsin and chymotrypsin was crystallized and its crystal structure was solved by molecular replacement. A ternary complex of the black-eyed pea trypsin and chymotrypsin inhibitor (BTCI) with trypsin and chymotrypsin was crystallized by the sitting-drop vapour-diffusion method with 0.1 M HEPES pH 7.5, 10%(w/v) polyethylene glycol 6000 and 5%(v/v) 2-methyl-2,4-pentanediol as precipitant. BTCI is a small protein with 83 amino-acid residues isolated from Vigna unguiculata seeds and is able to inhibit trypsin and chymotrypsin simultaneously by forming a stable ternary complex. X-ray data were collected from a single crystal of the trypsin–BTCI–chymotrypsin ternary complex to 2.7 Å resolution under cryogenic conditions. The structure of the ternary complex was solved by molecular replacement using the crystal structures of the BTCI–trypsin binary complex (PDB code) and chymotrypsin (PDB code) as search models.

  7. Assessment of ternary iron-cyclodextrin-2-naphthol complexes using NMR and fluorescence spectroscopies

    Science.gov (United States)

    Zheng, Weixi; Tarr, Matthew A.

    2006-12-01

    Recent research has indicated that ternary complexes can be formed among carboxymethyl-β-cyclodextrin, certain polycyclic aromatic hydrocarbons (PAHs) (e.g. anthracene and 2-naphthol), and Fe 2+ in aqueous solution. The formation of these ternary complexes has been suggested as the reason for improved reaction efficiency in iron catalyzed Fenton degradation (H 2O 2 + Fe 2+ → rad OH + OH - + Fe 3+) of PAHs and other pollutants. In the present work, several other cyclodextrins were examined to determine their ability to form similar ternary complexes with 2-naphthol and Fe 2+. Fluorescence and NMR techniques were employed in this study. Results showed that hydroxypropyl-β-cyclodextrin, β-cyclodextrin, and α-cyclodextrin were able to encapsulate 2-naphthol molecules, but their binding with Fe 2+ was weak. On the contrary, sulfated-β-cyclodextrin has significant binding with Fe 2+, but it showed little inclusion of 2-naphthol molecules. Consequently, none of these four cyclodextrins formed significant amounts of ternary complexes in aqueous solution. The techniques used in this study provide useful methods for assessing the ability of cyclodextrins to form ternary complexes with guest compounds and metal ions.

  8. G protein activation by G protein coupled receptors: ternary complex formation or catalyzed reaction?

    Science.gov (United States)

    Roberts, David J; Waelbroeck, Magali

    2004-09-01

    G protein coupled receptors catalyze the GDP/GTP exchange on G proteins, thereby activating them. The ternary complex model, designed to describe agonist binding in the absence of GTP, is often extended to G protein activation. This is logically unsatisfactory as the ternary complex does not accumulate when G proteins are activated by GTP. Extended models taking into account nucleotide binding exist, but fail to explain catalytic G protein activation. This review puts forward an enzymatic model of G protein activation and compares its predictions with the ternary complex model and with observed receptor phenomenon. This alternative model does not merely provide a new set of formulae but leads to a new philosophical outlook and more readily accommodates experimental observations. The ternary complex model implies that, HRG being responsible for efficient G protein activation, it should be as stable as possible. In contrast, the enzyme model suggests that although a limited stabilization of HRG facilitates GDP release, HRG should not be "too stable" as this might trap the G protein in an inactive state and actually hinder G protein activation. The two models also differ completely in the definition of the receptor "active state": the ternary complex model implies that the active state corresponds to a single active receptor conformation (HRG); in contrast, the catalytic model predicts that the active receptor state is mobile, switching smoothly through various conformations with high and low affinities for agonists (HR, HRG, HRGGDP, HRGGTP, etc.).

  9. Ternary Complexation on Bacterial Surfaces: Implications for Subsurface Anion Transport

    Science.gov (United States)

    Maclean, L. C.; Higginbottom, C. M.; Fowle, D. A.

    2002-12-01

    (VI) and I- in the presence of background electrolyte and aqueous Al (III), Cd(II), Ca(II) or cells coated with Al (oxy)hydroxide phases. We use a unique blend of XRD, electrophoretic mobility, SEM, and aqueous geochemistry measurements to quantify the mechanisms of Cr(VI) and I- removal from solution. Our results indicate the removal of both anions is highly dependent on solution pH with significant removal at low pH and diminishing removal at higher pH values, without the presence of cations or precipitates. However, in the presence of aqueous Cd(II) and Ca(II) which adsorbs strongly from pH 3.5-8, the removal of Cr(VI) and I- increases appreciably. Furthermore the loading of the cell surface with small amorphous mineral phases increases adsorption. Aging of the mineral-bacteria composites appears to decrease removal efficiency due to coarsening of the mineral phases and a decrease in charge density. Considering that many geologic environments include both cationic and anionic metal contaminants, our results suggest that mass transport of Cr(VI), I-, and other anions may be affected by ternary complexation or other cation mediated surface reactions in bacteria-bearing systems.

  10. Low levels of the 150-kD insulin-like growth factor binding protein 3 ternary complex in patients with anorexia nervosa: effect of partial weight recovery

    DEFF Research Database (Denmark)

    Støving, René K; Hangaard, Jørgen; Hagen, Claus

    2003-01-01

    on the ternary complex formation. Despite GH hypersecretion, serum IGF-I, IGFBP-3, and ALS levels have all been reported to be low in patients with anorexia nervosa (AN), while the degree of ternary complex formation in AN is unknown. METHODS: Serum ALS and 150-kD ternary complex formation were measured in 6...... of each of the three components of the 150-kDa ternary IGFBP-3 complex and in the formation of the complex itself....

  11. Triethanolamine Stabilization of Methotrexate-β-Cyclodextrin Interactions in Ternary Complexes

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    Jahamunna A. A. Barbosa

    2014-09-01

    Full Text Available The interaction of methotrexate (MTX with beta-cyclodextrin (β-CD in the presence of triethanolamine (TEA was investigated with the aim to elucidate the mechanism whereby self-assembly cyclodextrin systems work in association with this third component. Solubility diagram studies showed synergic increment of the MTX solubility to be about thirty-fold. Experiments using 2D ROESY and molecular modeling studies revealed the inclusion of aromatic ring III of the drug into β-CD cavity, in which TEA contributes by intensifying MTX interaction with β-CD and stabilizes MTX:β-CD:TEA ternary complex by electrostatic interaction. The maintenance of these interactions in solid phase was also studied in ternary MTX:β-CD:TEA and comparisons were made with freeze dried binary MTX:β-CD and physical mixtures. FTIR studies evidenced that MTX–β-CD interaction remained in solid ternary complexes, which was also supported by thermal (differential scanning calorimetry (DSC, thermogravimetric analysis (TG/first derivative of TG analysis (DTG and C,N,H elementary analysis and structural (X-ray diffraction analysis, (XRD studies, mainly regarding the increment of drug stability. The efficient in vitro drug dissolution studies successfully demonstrated the contribution of ternary complexes, which highlights the importance of this possible new raw material for further applications in drug delivery systems.

  12. Triethanolamine Stabilization of Methotrexate-β-Cyclodextrin Interactions in Ternary Complexes

    Science.gov (United States)

    Barbosa, Jahamunna A. A.; Zoppi, Ariana; Quevedo, Mario A.; de Melo, Polyanne N.; de Medeiros, Arthur S. A.; Streck, Letícia; de Oliveira, Alice R.; Fernandes-Pedrosa, Matheus F.; Longhi, Marcela R.; da Silva-Júnior, Arnóbio A.

    2014-01-01

    The interaction of methotrexate (MTX) with beta-cyclodextrin (β-CD) in the presence of triethanolamine (TEA) was investigated with the aim to elucidate the mechanism whereby self-assembly cyclodextrin systems work in association with this third component. Solubility diagram studies showed synergic increment of the MTX solubility to be about thirty-fold. Experiments using 2D ROESY and molecular modeling studies revealed the inclusion of aromatic ring III of the drug into β-CD cavity, in which TEA contributes by intensifying MTX interaction with β-CD and stabilizes MTX:β-CD:TEA ternary complex by electrostatic interaction. The maintenance of these interactions in solid phase was also studied in ternary MTX:β-CD:TEA and comparisons were made with freeze dried binary MTX:β-CD and physical mixtures. FTIR studies evidenced that MTX–β-CD interaction remained in solid ternary complexes, which was also supported by thermal (differential scanning calorimetry (DSC), thermogravimetric analysis (TG)/first derivative of TG analysis (DTG) and C,N,H elementary analysis) and structural (X-ray diffraction analysis, (XRD)) studies, mainly regarding the increment of drug stability. The efficient in vitro drug dissolution studies successfully demonstrated the contribution of ternary complexes, which highlights the importance of this possible new raw material for further applications in drug delivery systems. PMID:25257529

  13. Study of copper(II) ternary complexes with phosphocreatine and some polyamines in aqueous solution.

    Science.gov (United States)

    Szyfman, Natalie W; Loureiro, Nina P; Tenório, Thaís; Mercê, Ana L R; Mangrich, Antônio Sálvio; Rey, Nicolás A; Felcman, Judith

    2011-12-01

    Ternary systems of Cu(II) with phosphocreatine (PCr) and the polyamines (PAs), ethylenediamine (en), 1,3-diaminopropane (tn), putrescine (Put), spermidine (Spd), and spermine (Spm), were investigated in aqueous solution through potentiometry, ultraviolet-visible, EPR and Raman spectroscopy. The binary complex CuPCr was also studied by Raman spectroscopy, and the calculation of the minimum stabilization energy was done assuming this molecule in aqueous solution. The stability constants of the CuPCrPA ternary complexes were determined by potentiometry (T=25°C, I=0.1 mol L(-1), KNO(3)). The stability order determined was CuPCrSpm>CuPCrSpd>CuPCren>CuPCrtn>CuPCrPut, the same order of the corresponding binary complexes of Cu(II) with these polyamines. The evaluation of intramolecular PA-PCr interactions in protonated and deprotonated species of ternary complexes was carried out using the equation Δlog K=log β(CuPCrPAHq+p)-(log β(CuPAHq)+log β(CuPCrHp)). All of the CuPCrPA ternary complexes have a square planar structure and are bonded to PCr through the nitrogen atom of the guanidine group and the oxygen atom of the phosphate group, and to the PAs through two nitrogen atoms of the amine groups. The structure of the complex CuPCrSpm is planar with distortion towards tetrahedral. Calculation of the minimum stabilization energy for the CuPCr and CuPCrenH complexes confirmed the proposed coordination mode. Copyright © 2011 Elsevier Inc. All rights reserved.

  14. Preparation and Catalytic Properties of Polymer-Bound Schiff Base Ternary Complexes

    Institute of Scientific and Technical Information of China (English)

    HAO Cheng-jun; WANG Rong-min; HE Yu-feng; WANG Yun-pu; XIA Chun-gu

    2004-01-01

    The polymer-bound Schiff base ternary manganese complexes [PS-SalPhe-Mn-L (L = Phen, Bipy and 8HQ)-] have been prepared from the polymer-bound Schiff base ligand, a manganese salt and the second ligand, such as 1,10-phenanthroline(phen), 2,2′-bipyridyl(bipy) and 8-quinolinol(8HQ). The polymer-bound Schiff base ternary manganese complexes were characterized by means of infrared spectrometry and ICPAES. The catalytic activities of the complexes have been studied in the aerobic epoxidation of long-chain linear a[iphatic olefins. It is shown that 1-octene or 1-decene can be directly oxidized by molecular oxygen when catalyzed by PS-SalPhe-Mn-L(L=Phen, Bipy and 8HQ), and 1,2-epoxy alkane can be afforded in these reactions.

  15. Studies of the Intramolecular Aromatic-ring Stacking Interactions in the Ternary Platinum(Ⅱ) Complexes

    Institute of Scientific and Technical Information of China (English)

    SUN Hong-liang

    2005-01-01

    The stability constants of some ternary mixed-ligand complexes, Pt(Phen)(CA)+, where Phen=1,10-phenanthroline and CA- =carboxylate, were determined by means of potentiometric pH titration in aqueous solutions(I=0.1 mol/L, KNO3; 25 ℃), and the stability of them was compared with that of the corresponding binary complexes. It was revealed that the ternary complexes containing phenylalkane carboxylates ligands(PCA-) are much more stable than those formed with formate and acetate. The results indicate that there exist the intramolecular aromatic-ring interactions between the phenanthroline ring of Phen and the phenyl moiety of ligand PCA- in the ternary mixed-ligand Pt(Phen)(PCA)- complexes. The extent of the stacking interactions, which depends on the number of methylene groups between the phenyl moieties and the coordinated phenylalkane carboxylate groups, was calculated. The best-fitted stack was obtained for the complexes with 2-phenylacetate and 3-phenylpropionate as the ligands.

  16. Lethal synergism between organic and inorganic wood preservatives via formation of an unusual lipophilic ternary complex

    Energy Technology Data Exchange (ETDEWEB)

    Sheng, Zhi-Guo; Li, Yan; Fan, Rui-Mei; Chao, Xi-Juan [State Key Laboratory of Environmental Chemistry and Ecotoxicology, Research Center for Eco-Environmental Science, Chinese Academy of Sciences, Beijing 100085 (China); Zhu, Ben-Zhan, E-mail: bzhu@rcees.ac.cn [State Key Laboratory of Environmental Chemistry and Ecotoxicology, Research Center for Eco-Environmental Science, Chinese Academy of Sciences, Beijing 100085 (China); Linus Pauling Institute, Oregon State University, Corvallis, OR 97331 (United States)

    2013-02-01

    We have shown previously that exposing bacteria to wood preservatives pentachlorophenol (PCP) and copper-containing compounds together causes synergistic toxicity. However, it is not clear whether these findings also hold true in mammalian cells; and if so, what is the underlying molecular mechanism? Here we show that PCP and a model copper complex bis-(1,10-phenanthroline) cupric (Cu(OP){sub 2}), could also induce synergistic cytotoxicity in human liver cells. By the single crystal X-ray diffraction and atomic absorption spectroscopy assay, the synergism was found to be mainly due to the formation of a lipophilic ternary complex with unusual structural and composition characteristics and subsequent enhanced cellular copper uptake, which markedly promoted cellular reactive oxygen species (ROS) production, leading to apoptosis by decreasing mitochondrial membrane potential, increasing pro-apoptotic protein expression, releasing cytochrome c from mitochondria and activating caspase-3, and -9. Analogous results were observed with other polychlorinated phenols (PCPs) and Cu(OP){sub 2}. Synergistic cytotoxicity could be induced by PCP/Cu(OP){sub 2} via formation of an unusual lipophilic complex in HepG2 cells. The formation of ternary complexes with similar lipophilic character could be of relevance as a general mechanism of toxicity, which should be taken into consideration especially when evaluating the toxicity of environmental pollutants found at currently-considered non- or sub-toxic concentrations. -- Highlights: ► The combination of PCP/Cu(OP){sub 2} induces synergistic cytotoxicity in HepG2 cells. ► The synergism is mainly due to forming a lipophilic ternary complex between them. ► The formation of lipophilic ternary complex enhances cellular copper uptake. ► PCP/Cu(OP){sub 2} stimulates the cellular ROS production. ► The ROS promoted by PCP/Cu(OP){sub 2} induces mitochondria-dependent apoptosis.

  17. Self-assembled ternary complexes stabilized with hyaluronic acid-green tea catechin conjugates for targeted gene delivery.

    Science.gov (United States)

    Liang, Kun; Bae, Ki Hyun; Lee, Fan; Xu, Keming; Chung, Joo Eun; Gao, Shu Jun; Kurisawa, Motoichi

    2016-03-28

    Nanosized polyelectrolyte complexes are attractive delivery vehicles for the transfer of therapeutic genes to diseased cells. Here we report the application of self-assembled ternary complexes constructed with plasmid DNA, branched polyethylenimine and hyaluronic acid-green tea catechin conjugates for targeted gene delivery. These conjugates not only stabilize plasmid DNA/polyethylenimine complexes via the strong DNA-binding affinity of green tea catechin, but also facilitate their transport into CD44-overexpressing cells via receptor-mediated endocytosis. The hydrodynamic size, surface charge and physical stability of the complexes are characterized. We demonstrate that the stabilized ternary complexes display enhanced resistance to nuclease attack and polyanion-induced dissociation. Moreover, the ternary complexes can efficiently transfect the difficult-to-transfect HCT-116 colon cancer cell line even in serum-supplemented media due to their enhanced stability and CD44-targeting ability. Confocal microscopic analysis demonstrates that the stabilized ternary complexes are able to promote the nuclear transport of plasmid DNA more effectively than binary complexes and hyaluronic acid-coated ternary complexes. The present study suggests that the ternary complexes stabilized with hyaluronic acid-green tea catechin conjugates can be widely utilized for CD44-targeted delivery of nucleic acid-based therapeutics.

  18. A study of the formation constants of ternary and quaternary complexes of some bivalent transition metals

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    MADHURJYA NEOG

    2010-01-01

    Full Text Available The formation of hetero-ligand 1:1:1, M(II-Opda-Sal/Gly ternary and 1:1:1:1, M(II-Opda-Sal-Gly quaternary complexes, where M(II = Ni, Cu, Zn and Cd; Opda = o‑phenylenediamine, Sal = salicylic acid, Gly = glycine, was studied pH-metrically in aqueous medium. The formation constants for the resulting ternary and quaternary complexes were evaluated at a constant ionic strength, μ = 0.20 mol dm-3 and temperature, 30±0.1 °C. The order of the formation constants in terms of the metal ion for both type of complexes was found to be Cu(II > Ni(II > Zn(II > Cd(II. This order was explained based on the increasing number of fused rings, the coordination number of the metal ions, the Irving – William order and the stability of various species. The expected species formed in solution were pruned with the Fortran IV program SPEPLOT and the stability of the ternary and quaternary complexes is explained.

  19. Quantifying the energetics of cooperativity in a ternary protein complex

    DEFF Research Database (Denmark)

    Andersen, Peter S; Schuck, Peter; Sundberg, Eric J

    2002-01-01

    The formation of complexes involving more than two proteins is critical for many cellular processes, including signal transduction, transcriptional control, and cytoskeleton remodeling. Energetically, these interactions cannot always be described simply by the additive effects of the individual b...

  20. Regular Functions with Values in Ternary Number System on the Complex Clifford Analysis

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    Ji Eun Kim

    2013-01-01

    Full Text Available We define a new modified basis i^ which is an association of two bases, e1 and e2. We give an expression of the form z=x0+ i ^z0-, where x0 is a real number and z0- is a complex number on three-dimensional real skew field. And we research the properties of regular functions with values in ternary field and reduced quaternions by Clifford analysis.

  1. Metal-amino acid (or peptide)-nucleoside (or related bases) ternary complexes

    Energy Technology Data Exchange (ETDEWEB)

    Terron, A.; Fiol, J.J.; Herrero, L.A.; Garcia-Raso, A. [Departament de Quimica. Universitat de les Illes Balears. Palma de Mallorca. (Spain); Apella, M.C. [Cerela Centro de Referencia de Lactobacilos, Tucaman, Argentina (Antigua and Barbuda); Caubet, A.; Moreno, V. [Departament de Quimica Inorganica. Universitat de Barcelona. Barcelona (Spain)

    1997-05-01

    The knowledge of simultaneous metal ion interaction with proteins and nucleic acids is one of the most exciting subjects inside the Inorganic Biochemistry. In the last years, several groups have published articles on the synthesis and characterization of ternary complexes bringing relevant data on the structure and stability of metallo biomolecules. In this short review, the last contributions found in the literature are collected. Comments on the factors influencing the behaviour and stability of these systems are offered. (Author) 100 refs.

  2. Paradigms in the structural biology of the mitogenic ternary complex FGF:FGFR:heparin.

    Science.gov (United States)

    Pomin, Vitor H

    2016-08-01

    The main achievements regarding the molecular interaction involving fibroblast growth factors (FGFs), canonical receptors (FGFRs) and the glycosaminoglycans (GAGs) heparan sulfate (HS)/heparin (Hp) are overviewed. Despite the recent works concerning the subject, conflicting paradigms in the structural biology of the resultant ternary complex FGF:FGFR:HS/Hp seem to persist up to these days. The principal dilemma, centered on the functional intermolecular complex of mitogenesis and angiogenesis, has been lasting for approximately a decade and a half since the publications of the two contradicting crystal structures, the asymmetric 2:2:1 versus the symmetric 2:2:2 complex model. When the principal results regarding this ternary complex are analyzed as a whole and through an impartial manner, conclusion heavily and reliably supports the existence and activity of both complex models. Selection of each complex is driven by multiple factors of different degrees of impact. Specificity in protein-binding motifs in ligands (although the minimal binding sequences are yet controversial), slight differences on the structure of the GAG-binding sites of FGF and of FGFR isoforms as well as on the possible ligand-induced conformational changes of FGFR are examples of these factors. Here, the structural biology of the mitogenic FGF:FGFR:HS/Hp ternary complex is revisited. Discussion is focused on the major attributes of this intermolecular complex including the existing conflicts about the righter biologically active model and information regarding ligand structure, conformation and minimal length required for binding to the growth factors and receptors. This review is very timely in light of the 100(th) anniversary of the discovery of Hp.

  3. Drug-Induced Conformational Population Shifts in Topoisomerase-DNA Ternary Complexes

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    Nan-Lan Huang

    2014-06-01

    Full Text Available Type II topoisomerases (TOP2 are enzymes that resolve the topological problems during DNA replication and transcription by transiently cleaving both strands and forming a cleavage complex with the DNA. Several prominent anti-cancer agents inhibit TOP2 by stabilizing the cleavage complex and engendering permanent DNA breakage. To discriminate drug binding modes in TOP2-α and TOP2-β, we applied our newly developed scoring function, dubbed AutoDock4RAP, to evaluate the binding modes of VP-16, m-AMSA, and mitoxantrone to the cleavage complexes. Docking reproduced crystallographic binding mode of VP-16 in a ternary complex of TOP2-β with root-mean-square deviation of 0.65 Å. Molecular dynamics simulation of the complex confirmed the crystallographic binding mode of VP-16 and the conformation of the residue R503. Drug-related conformational changes in R503 have been observed in ternary complexes with m-AMSA and mitoxantrone. However, the R503 rotamers in these two simulations deviate from their crystallographic conformations, indicating a relaxation dynamics from the conformations determined with the drug replacement procedure. The binding mode of VP-16 in the cleavage complex of TOP2-α was determined by the conjoint use of docking and molecular dynamics simulations, which fell within a similar binding pocket of TOP2-β cleavage complex. Our findings may facilitate more efficient design efforts targeting TOP2-α specific drugs.

  4. Photophysical study of blue-light excitable ternary Eu(III) complexes and their encapsulation into polystyrene nanoparticles

    Energy Technology Data Exchange (ETDEWEB)

    Räsänen, Markus, E-mail: mpvras@utu.fi [Department of Chemistry, University of Turku, FIN-20014 Turku (Finland); Takalo, Harri [DHR Finland Oy, Innotrac Diagnostics, Biolinja 12, FIN-20750 Turku (Finland); Soukka, Tero [Department of Biochemistry/Biotechnology, University of Turku, FIN-20014 Turku (Finland); Haapakka, Keijo; Kankare, Jouko [Department of Chemistry, University of Turku, FIN-20014 Turku (Finland)

    2015-04-15

    In this work, 14 ternary Eu(III) complexes were studied by means of spectroscopy. The studied Eu(III) complexes consisted of Lewis bases (4′-(4-diethylaminophenyl)-2,2′:6′,2″-terpyridine (L{sup 8}) or 1,10-phenanthroline (L{sup 9})) and differently substituted β-diketones. The ternary complexes with L{sup 8} show the excitation peak at 405 nm and the quantum yield even 76%. The brightest ternary complex at the 405 nm excitation was Eu(L{sup 3}){sub 3}L{sup 8} while Eu(L{sup 7}){sub 3}L{sup 8} (HL{sup 3}=4,4,4-trifluoro-1-(2-thienyl)-1,3-butanedione, HL{sup 7}=1-(9-ethyl-9H-carbazol-3-yl)-4,4,5,5,5-pentafluoro-1,3-pentanedione) was found to be the brightest at the ligand-centred excitation maximum. The ternary complexes were studied mainly in toluene as the model environment for the polystyrene nanoparticle cavities. The complexes were successfully loaded into the polystyrene nanoparticles enabling their bioanalytical application in aqueous environment. The encapsulation of the complexes preserved, or even enhanced, their good photophysical features. - Highlights: • Ternary Eu{sup 3+} complexes with some β-diketone and substituted terpyridine were studied. • Ternary complexes with substituted terpyridine showed blue-light excitability. • Ternary complexes were successfully loaded into the polystyrene nanoparticles. • Encapsulation of the complexes preserved their good photophysical features.

  5. Crystal Structures of Murine Carnitine Acetyltransferase in Ternary Complexes with Its Substrates

    Energy Technology Data Exchange (ETDEWEB)

    Hsiao,Y.; Jogl, G.; Tong, L.

    2006-01-01

    Carnitine acyltransferases catalyze the reversible exchange of acyl groups between coenzyme A (CoA) and carnitine. They have important roles in many cellular processes, especially the oxidation of long-chain fatty acids in the mitochondria for energy production, and are attractive targets for drug discovery against diabetes and obesity. To help define in molecular detail the catalytic mechanism of these enzymes, we report here the high resolution crystal structure of wild-type murine carnitine acetyltransferase (CrAT) in a ternary complex with its substrates acetyl-CoA and carnitine, and the structure of the S554A/M564G double mutant in a ternary complex with the substrates CoA and hexanoylcarnitine. Detailed analyses suggest that these structures may be good mimics for the Michaelis complexes for the forward and reverse reactions of the enzyme, representing the first time that such complexes of CrAT have been studied in molecular detail. The structural information provides significant new insights into the catalytic mechanism of CrAT and possibly carnitine acyltransferases in general.

  6. Ternary WD40 repeat-containing protein complexes: evolution, composition and roles in plant immunity

    Directory of Open Access Journals (Sweden)

    Jimi C. Miller

    2016-01-01

    Full Text Available Plants, like mammals, rely on their innate immune system to perceive and discriminate among the majority of their microbial pathogens. Unlike mammals, plants respond to this molecular dialogue by unleashing a complex chemical arsenal of defense metabolites to resist or evade pathogen infection. In basal or non-host resistance, plants utilize signal transduction pathways to detect non-self, damaged-self and altered-self-associated molecular patterns and translate these danger signals into largely inducible chemical defenses. The WD40 repeat (WDR-containing proteins Gβ and TTG1 are constituents of two independent ternary protein complexes functioning at opposite ends of a plant immune signaling pathway. Gβ and TTG1 are also encoded by single-copy genes that are ubiquitous in higher plants, implying the limited diversity and functional conservation of their respective complexes. In this review, we summarize what is currently known about the evolutionary history of these WDR-containing ternary complexes, their repertoire and combinatorial interactions, and their downstream effectors and pathways in plant defense.

  7. Synthesis, characterization and antibacterial studies of a copper(II) levofloxacin ternary complex.

    Science.gov (United States)

    Sousa, Isabel; Claro, Vasco; Pereira, João Lino; Amaral, Ana Luísa; Cunha-Silva, Luís; de Castro, Baltazar; Feio, Maria J; Pereira, Eulália; Gameiro, Paula

    2012-05-01

    Solution behavior of levofloxacin (lvx) complexes with copper(II) in the presence and absence of phen was studied in aqueous solution, by potentiometry. The results obtained show that under physiological conditions (micromolar concentration range and pH 7.4) only copper(II):lvx:phen ternary complexes are stable. Hence, a novel copper(II) ternary complex of fluoroquinolone levofloxacin with nitrogen donor heterocyclic ligand phen was synthesized and characterized by means of UV-Visible and IR spectroscopy, elemental analysis and X-Ray crystallography. In the synthesized complex (1), [Cu(lvx)(phen)(H(2)O)](NO(3)).2H(2)O, levofloxacin acts as a bidentate ligand coordinating to the metal, in its anionic form, through the carbonyl and carboxyl oxygens and phen coordinates through two N-atoms forming the equatorial plane of a distorted square-pyramidal geometry. The fifth ligand of the penta-coordinated Cu(II) centre is occupied axially by an oxygen atom from a water molecule. Minimum inhibitory concentration (MIC) determinations of the complex and comparison with free levofloxacin in various E. coli strains indicated that the Cu-complex is as efficient an antimicrobial as the free antibiotic (both in the case of the dissolved synthesized complex and the complex formed following stoichiometric mixture of the individual components in solution). Moreover, results strongly suggest that the cell intake route of both species is different supporting, therefore, the complex's suitability as a candidate for further biological testing in fluoroquinolone-resistant microorganisms.

  8. Synthesis and Photoluminescence of Three Europium (Ⅲ) Ternary Complexes with New Secondary Ligands of Different Structure

    Institute of Scientific and Technical Information of China (English)

    袁继兵; 李嘉航; 梁万里; 苏树江; 石建新; 龚孟濂

    2004-01-01

    Three new 1,10-phenanthroline derivatives, dipyrido (3,2-f: 2,3-h) quinoxaline (DPQN), imidazo (5,6-f)-(1,10)-phenanthroline (IP) and 3-phenyl-imidazo (5,6-f)-(1,10)-phenanthroline (PIP) were designed and synthesized as a secondary ligand to coordinate with europium (Ⅲ) ion while dibenzoylmethane (DBM) was used as the first ligand. The compositions of the ligands and the europium (Ⅲ) ternary complexes were confirmed by elementary analysis, IR and 1H-NMR spectroscopy. The UV-visible absorption spectra, thermal stability, photoluminescence spectra, quantum yield and fluorescence life time of the Eu(Ⅲ) complexes were investigated. The effect of the structure of the secondary ligand on the photoluminescence of the complexes was discussed. The results show that the synthesized Eu(Ⅲ) complexes are good red-emitiing materials for potential application in fabrication of organic electroluminescence devices.

  9. Synthesis, characterization and antibacterial studies of a copper(II) lomefloxacin ternary complex.

    Science.gov (United States)

    Fernandes, Patrícia; Sousa, Isabel; Cunha-Silva, Luís; Ferreira, Mariana; de Castro, Baltazar; Pereira, Eulália F; Feio, Maria J; Gameiro, Paula

    2014-02-01

    Solution behavior of lomefloxacin (lmx) complexes with copper(II) in the presence and absence of 1,10-phenanthroline (phen) was studied in aqueous solution, by potentiometry. The results obtained showed that under physiological conditions (micromolar concentration range and pH7.4) only copper(II):lmx:phen ternary complexes are stable. Hence, a novel copper(II) ternary complex of lomefloxacin with the nitrogen donor heterocyclic ligand phen was synthesized and characterized by means of UV-visible and IR spectroscopy, elemental analysis and X-ray crystallography. In the synthesized complex (1), [Cu(lmx)(phen)(NO3)]·5H2O, lmx acts as a bidentate ligand coordinating the metal cation, in its anionic form, through the carbonyl and carboxyl oxygens and phen coordinates through two N-atoms forming the equatorial plane of a distorted square-pyramidal geometry. The fifth ligand of the penta-coordinated Cu(II) center is occupied axially by an oxygen atom from the nitrate ion. Minimum inhibitory concentration (MIC) determinations of the complex and comparison with free lomefloxacin in various E. coli strains indicated that the Cu-complex is an antimicrobial which is as efficient as the free antibiotic but strongly suggest that the cell intake route of both species is different. Moreover, spectrophotometric stability studies suggest that the solution of the complex synthesized is considerably more photostable than the free fluoroquinolone supporting, therefore, the complex's suitability as a candidate for further biological testing in fluoroquinolone-resistant microorganisms with possible reduced side-effects.

  10. Ternary metal complexes of guaifenesin drug: Synthesis, spectroscopic characterization and in vitro anticancer activity of the metal complexes.

    Science.gov (United States)

    Mahmoud, W H; Mahmoud, N F; Mohamed, G G; El-Sonbati, A Z; El-Bindary, A A

    2015-01-01

    The coordination behavior of a series of transition metal ions named Cr(III), Fe(III), Mn(II), Co(II), Ni(II), Cu(II), Zn(II) and Cd(II) with a mono negative tridentate guaifenesin ligand (GFS) (OOO donation sites) and 1,10-phenanthroline (Phen) is reported. The metal complexes are characterized based on elemental analyses, IR, (1)H NMR, solid reflectance, magnetic moment, molar conductance, UV-vis spectral studies, mass spectroscopy, ESR, XRD and thermal analysis (TG and DTG). The ternary metal complexes were found to have the formulae of [M(GFS)(Phen)Cl]Cl·nH2O (M=Cr(III) (n=1) and Fe(III) (n=0)), [M(GFS)(Phen)Cl]·nH2O (M=Mn(II) (n=0), Zn(II) (n=0) and Cu(II) (n=3)) and [M(GFS)(Phen)(H2O)]Cl·nH2O (M=Co(II) (n=0), Ni(II) (n=0) and Cd(II) (n=4)). All the chelates are found to have octahedral geometrical structures. The ligand and its ternary chelates are subjected to thermal analyses (TG and DTG). The GFS ligand, in comparison to its ternary metal complexes also was screened for their antibacterial activity on gram positive bacteria (Bacillus subtilis and Staphylococcus aureus), gram negative bacteria (Escherichia coli and Neisseria gonorrhoeae) and for in vitro antifungal activity against (Candida albicans). The activity data show that the metal complexes have antibacterial and antifungal activity more than the parent GFS ligand. The complexes were also screened for its in vitro anticancer activity against the Breast cell line (MFC7) and the results obtained show that they exhibit a considerable anticancer activity. Copyright © 2015 Elsevier B.V. All rights reserved.

  11. Combined modality treatment with ternary Cu(II) complexes and X rays.

    Science.gov (United States)

    O'Hara, J A; Douple, E B; Abrams, M J; Giandomenico, C M; Bradley, F C; McElligott, M A; Caruso, F S

    1992-01-01

    Ternary Cu(II) complexes with bidentate malonato- and heterocyclic amine ligands were tested with regard to cytotoxicity and potentiation of x-ray induced cell killing in V79 cells. Two lead complexes were also tested in a tumor assay using the MTG-B murine adenocarcinoma model growing in the flanks of female C3H/HeJ mice. One complex, [2,2'-bipyridyl malonatoCu(II)] (RL-5077), produced sensitizer enhancement ratios (SER's) of 1.8 (hypoxic conditions) and 1.0 (oxic conditions) in vitro when irradiation followed 1 hr exposure to the drug at 100 microM. When RL-5077 was administered at doses of 1/2 (11.65 mg/kg) or 1/4 (5.25 mg/kg) the maximum tolerated dose (MTD), 15 min prior to a locally delivered dose of 20 Gy, enhancement ratios (ER's) of 1.6 and 2, respectively, resulted. The second lead complex, [1,10 phenanthroline (malonato)Cu(II)hydrate] (RL-5027), produced SER's of 1.8 and 1.2 under hypoxic and oxic conditions, respectively, at a concentration of 25 microM. Injection of RL-5027 (5 mg/kg) resulted in toxicity without enhancement in combination with radiation. Analogues of these two complexes have been synthesized in an effort to optimize the potentiation of radiation effects while minimizing toxicity to drug alone and increasing water solubility of the drug. Further studies of the structure-activity relationship of Cu(II) ternary complexes using in vitro radiosensitization as the endpoint have identified four classes of ligands with varying biological activity and have supplied information about the effects of group substitution on solubility, toxicity, and radiation potentiation. This group of complexes represents a new class of radiopotentiators that deserves further investigation into its potential for clinical use.

  12. Photophysical Property of Ternary Complex Eu(DPHA)3*Phen*2H20

    Institute of Scientific and Technical Information of China (English)

    王明召; 王淑贤; 蔡冠梁

    2001-01-01

    One ternary complex of europium with the plant growth regulator HDPHA (2-Hydroxydiphenyl acetic acid) and Phen (1,10-Phenanthroline), Eu(DPHA)3*Phen*2H2O, was synthesized and characterized by the elemental analysis and DTA-TG measurement. The photophysical property of the complex was investigated by means of IR spectra, Raman spectrum and laser-exited, high-resolved excitation and emission spectra as well as time-resolved luminescence spectra. The luminescence spectra reveal four Eu3+ sites with energy difference within 25 cm-1 and local symmetries of C1 or C2 or Cs in the complex. The energy transfer among the Eu3+ sites is observed. The 7FJ sublevel splitting of the Eu3+ ion is discussed.

  13. Molecular assembly of the ternary granulocyte-macrophage colony-stimulating factor receptor complex.

    Science.gov (United States)

    McClure, Barbara J; Hercus, Timothy R; Cambareri, Bronwyn A; Woodcock, Joanna M; Bagley, Christopher J; Howlett, Geoff J; Lopez, Angel F

    2003-02-15

    Granulocyte-macrophage colony-stimulating factor (GM-CSF) is a hematopoietic cytokine that stimulates the production and functional activity of granulocytes and macrophages, properties that have encouraged its clinical use in bone marrow transplantation and in certain infectious diseases. Despite the importance of GM-CSF in regulating myeloid cell numbers and function, little is known about the exact composition and mechanism of assembly of the GM-CSF receptor complex. We have now produced soluble forms of the GM-CSF receptor alpha chain (sGMRalpha) and beta chain (sbetac) and utilized GM-CSF, the GM-CSF antagonist E21R (Glu21Arg), and the betac-blocking monoclonal antibody BION-1 to define the molecular assembly of the GM-CSF receptor complex. We found that GM-CSF and E21R were able to form low-affinity, binary complexes with sGMRalpha, each having a stoichiometry of 1:1. Importantly, GM-CSF but not E21R formed a ternary complex with sGMRalpha and sbetac, and this complex could be disrupted by E21R. Significantly, size-exclusion chromatography, analytical ultracentrifugation, and radioactive tracer experiments indicated that the ternary complex is composed of one sbetac dimer with a single molecule each of sGMRalpha and of GM-CSF. In addition, a hitherto unrecognized direct interaction between betac and GM-CSF was detected that was absent with E21R and was abolished by BION-1. These results demonstrate a novel mechanism of cytokine receptor assembly likely to apply also to interleukin-3 (IL-3) and IL-5 and have implications for our molecular understanding and potential manipulation of GM-CSF activation of its receptor.

  14. Synthesis and spectral characterization of ternary mixed-vanadyl β-diketonate complexes with Schiff bases.

    Science.gov (United States)

    Baranwal, Balram Prasad; Tripathi, Kiran; Singh, Alok Kumar; Tripathi, Saurabh

    2012-06-01

    A new method to synthesize some mononuclear ternary oxovanadium(IV) complexes of the general formula [VO(β-dike)(SB)] (where Hβ-dike=acetylacetone; benzoylacetone or dibenzoylmethane, HSB=Schiff bases) has been explored by stepwise substitutions of acetylacetonate ion of VO(acac)(2) with Schiff bases. The substituted acetylacetone could be fractionated out with p-xylene as an azeotrope. The complexes were characterized by elemental analyses, molecular weight determinations, spectral (electronic, infrared, (1)H NMR, EPR and powder XRD) studies, magnetic susceptibility measurements and cyclic voltammetry. Molar conductance measurements indicated the complexes to be non-electrolytes in nitrobenzene. Bidentate chelating nature of β-diketones and Schiff base anions in the complexes was established by infrared and NMR spectra. Molecular weight determinations confirmed mononuclear nature of the complexes. The EPR spectra illustrated coupling of the unpaired electron with (51)V nucleus (I=7/2). Cyclic voltammograms of all the complexes displayed two-step oxidation processes. The oxidation peak potential corresponded to the quasireversible one-electron oxidation process of the metal center, yielding V(V) species. Transmission electron microscopy (TEM) indicated spherical particles of ∼200 nm diameter. The synthesized complexes are mixed-ligand complexes showing a considerable hydrolytic stability in which vanadium is having coordination number 5. A square pyramidal geometry around vanadium has been assigned in all the complexes.

  15. Investigation of Surfactant-Stain-Metal Interaction: Naphthochrome Green/Cetyltrimethylammonium Bromide/Rare Earths Ternary Complexation

    Institute of Scientific and Technical Information of China (English)

    郑立新; 沈荣; 郜洪文

    2003-01-01

    The ternary interaction of naphthochrome green (NCG) with cetyltrimethylammonium bromide (CTAB) and rare earths (Res: Yb, Dy, Er and Eu) has been investigated with the microsurface adsorption-spectral correction technique (MSASC). The aggregation of NCG on CTAB obeys the Langmuir isothermal adsorption. The enrichment of NCG on CTAB and the presence of NaCl sensitize the complexation between Res and NCG. Both the binary aggregate and the ternary complex were characterized in the presence and absence of NaCl at pH 8.30 at 20 and 40℃.

  16. Recognition and sensing of low-epitope targets via ternary complexes with oligonucleotides and synthetic receptors

    Science.gov (United States)

    Yang, Kyung-Ae; Barbu, Mihaela; Halim, Marlin; Pallavi, Payal; Kim, Benjamin; Kolpashchikov, Dmitry M.; Pecic, Stevan; Taylor, Steven; Worgall, Tilla S.; Stojanovic, Milan N.

    2014-11-01

    Oligonucleotide-based receptors or aptamers can interact with small molecules, but the ability to achieve high-affinity and specificity of these interactions depends strongly on functional groups or epitopes displayed by the binding targets. Some classes of targets are particularly challenging: for example, monosaccharides have scarce functionalities and no aptamers have been reported to recognize, let alone distinguish from each other, glucose and other hexoses. Here we report aptamers that differentiate low-epitope targets such as glucose, fructose or galactose by forming ternary complexes with high-epitope organic receptors for monosaccharides. In a follow-up example, we expand this method to isolate high-affinity oligonucleotides against aromatic amino acids complexed in situ with a nonspecific organometallic receptor. The method is general and enables broad clinical use of aptamers for the detection of small molecules in mix-and-measure assays, as demonstrated by monitoring postprandial waves of phenylalanine in human subjects.

  17. Binary and ternary complexation of NpO{sub 2}{sup +} with carboxylate and aminocarboxylate ligands

    Energy Technology Data Exchange (ETDEWEB)

    Thakur, Punam [Florida State Univ., Tallahassee, FL (United States). Dept. of Chemistry and Biochemistry; Van Luik, Abraham E. [Department of Energy, Carlsbad Field Office, NM (United States)

    2014-11-01

    The complex formation of NpO{sub 2}{sup +} with carboxylates: oxalic acid (Ox), malonic acid (Mal) succinic acid (Suc); glutaric acid (Glu), methylmalonic acid (Memal), oxydiacetic acid (ODA), TDA (thiodiacetic acid) and citric acid (Cit) and aminocarboxylates: iminodiacetic acid (IDA), methyliminodiacetic acid (MIDA), nitrilotriacetic acid (NTA), 2-hydroxyethylethylenediamine triacetic acid (HEDTA), ethylenediaminetetraacetic acid (EDTA) and diethylenetriaminepentaacetic acid (DTPA) was studied by solvent extraction in 6.60 m NaClO{sub 4} at 25 C. The formation of only the 1: 1 NpO{sub 2}{sup +} complex was observed with the ligands under investigation. The complexation of NpO{sub 2}{sup +} with Ox, IDA, ODA and TDA was also measured at variable temperatures ranging from 25-60 C in 6.60 m NaClO{sub 4}. Results show that the complexation of NpO{sub 2}{sup +} with these ligands increases with increasing temperature. The enthalpy and entropy of complexation of NpO{sub 2}{sup +} were calculated from the temperature dependence of the stability constants using the Van't Hoff equation. Additionally, the formation of an aqueous ternary complex of the form NpO{sub 2}(X)(L) (X = EDTA or HEDTA; L = Ox or ODA) was identified for NpO{sub 2}{sup +} at 25 C. Stabilities of these complexes are measured and discussed in term of their structures and basicities.

  18. Formation of ternary complexes between a macrotricyclic host and hetero-guest pairs: an acid-base controlled selective complexation process.

    Science.gov (United States)

    Han, Tao; Chen, Chuan-Feng

    2007-10-11

    A triptycene-based cylindrical macrotricyclic host can include diquat and electron-rich aromatics simultaneously to form stable ternary complexes, which is stabilized not only by a charge-transfer (CT) interaction between electron-rich and electron-deficient guests but also by the face to face pi-stacking interactions between the host and the guests. Moreover, a selective complexation process between a ternary complex containing benzidine and a binary complex can be effectively controlled by the use of acid and base.

  19. Spectral characterization, crystal structures and biological activities of iminodiacetate ternary complexes

    Science.gov (United States)

    Shahid, M.; Anjuli; Tasneem, Sana; Mantasha, I.; Ahamad, M. Naqi; Sama, Farasha; Fatma, Kehkeshan; Siddiqi, Zafar A.

    2017-10-01

    The ternary complexes with stoichiometry [M(imda)(bipy)]·6H2O (M = Cu) and [M(imda)(bipy)(H2O)]·4H2O (M = Ni, Co and Mn) where H2imda = iminodiacetic acid and bipy = 2,2‧-bipyridine, are prepared and characterized to exploit as novel antimicrobial agents and SOD mimics. The chemical structures were elucidated by IR, FAB-Mass, 1H, 13C NMR, EPR and spectral techniques. Single crystal X-ray and spectral studies of the complexes (1) and (2) have confirmed a square pyramidal geometry around Cu(II) ion while a saturated six coordinate (distorted octahedral) geometry around the Ni(II), Co(II) and Mn(II) ions due to the additional coordination from water. A supramolecular network is formed by extensive H-bonding in complex (1). The supramolecular assembly in complex (1) is additionally consolidated via the existence of unusual cyclic hexameric water clusters. The antimicrobial activities for the present complexes have been examined against Escherichia coli (K-12), Bacillus subtilis (MTC-121), Staphylococcus aureus (IOASA-22), Salmonella typhymurium (MTCC-98), Candida albicans, Aspergillus fumigatus and Penicillium marneffei. The superoxide dismutase (SOD) activity of the Cu(II) complex (1) is also assessed employing nitrobluetetrazolium (NBT) assay.

  20. The role of Glu259 in Escherichia coli elongation factor Tu in ternary complex formation

    DEFF Research Database (Denmark)

    Nautrup Pedersen, Gitte; Rattenborg, Thomas; Knudsen, Charlotte Rohde;

    1998-01-01

    Determination of the crystal structure of the ternary complex formed between elongation factor Tu:GTP and aminoacylated tRNA revealed three regions of interaction between elongation factor Tu and tRNA. The structure indicates that the conserved glutamic acid at position 271 in Thermus aquaticus EF......-Tu could be involved in the binding of the 3' CCA-Phe end of the aminoacylated tRNA. Therefore, the corresponding residue, Glu259, of Escherichia coli EF-Tu was mutated into alanine, aspartic acid, glutamine and tyrosine, in order to substantiate the crystallographic structural evidence and to obtain...... of interaction with tRNA, while mutation to tyrosine abolished completely the interaction with tRNA. Finally, mutation to glutamine resulted in an elongation factor Tu variant behaving like the wild type. In conclusion, the environment around the site binding the CCA-Phe end of the tRNA is very restricted...

  1. Through-bond effects in the ternary complexes of thrombin sandwiched by two DNA aptamers

    Science.gov (United States)

    Pica, Andrea; Russo Krauss, Irene; Parente, Valeria; Tateishi-Karimata, Hisae; Nagatoishi, Satoru; Tsumoto, Kouhei; Sugimoto, Naoki; Sica, Filomena

    2017-01-01

    Aptamers directed against human thrombin can selectively bind to two different exosites on the protein surface. The simultaneous use of two DNA aptamers, HD1 and HD22, directed to exosite I and exosite II respectively, is a very powerful approach to exploit their combined affinity. Indeed, strategies to link HD1 and HD22 together have been proposed in order to create a single bivalent molecule with an enhanced ability to control thrombin activity. In this work, the crystal structures of two ternary complexes, in which thrombin is sandwiched between two DNA aptamers, are presented and discussed. The structures shed light on the cross talk between the two exosites. The through-bond effects are particularly evident at exosite II, with net consequences on the HD22 structure. Moreover, thermodynamic data on the binding of the two aptamers are also reported and analyzed. PMID:27899589

  2. Through-bond effects in the ternary complexes of thrombin sandwiched by two DNA aptamers.

    Science.gov (United States)

    Pica, Andrea; Russo Krauss, Irene; Parente, Valeria; Tateishi-Karimata, Hisae; Nagatoishi, Satoru; Tsumoto, Kouhei; Sugimoto, Naoki; Sica, Filomena

    2017-01-09

    Aptamers directed against human thrombin can selectively bind to two different exosites on the protein surface. The simultaneous use of two DNA aptamers, HD1 and HD22, directed to exosite I and exosite II respectively, is a very powerful approach to exploit their combined affinity. Indeed, strategies to link HD1 and HD22 together have been proposed in order to create a single bivalent molecule with an enhanced ability to control thrombin activity. In this work, the crystal structures of two ternary complexes, in which thrombin is sandwiched between two DNA aptamers, are presented and discussed. The structures shed light on the cross talk between the two exosites. The through-bond effects are particularly evident at exosite II, with net consequences on the HD22 structure. Moreover, thermodynamic data on the binding of the two aptamers are also reported and analyzed. © The Author(s) 2016. Published by Oxford University Press on behalf of Nucleic Acids Research.

  3. Encapsulation of nabumetone by means of -drug: ({beta}-cyclodextrin){sub 2}:polyvinylpyrrolidone ternary complex formation

    Energy Technology Data Exchange (ETDEWEB)

    Valero, Margarita [Departamento de Quimica Fisica, Facultad de Farmacia, Universidad de Salamanca, Salamanca (Spain)]. E-mail: mvalero@usal.es; Tejedor, Javier [Departamento de Quimica Fisica, Facultad de Farmacia, Universidad de Salamanca, Salamanca (Spain); Rodriguez, Licesio J. [Departamento de Quimica Fisica, Facultad de Farmacia, Universidad de Salamanca, Salamanca (Spain)

    2007-10-15

    The aim of the present study was to investigate the effect of the presence of the water-soluble polymer polyvinylpyrrolidone (PVP) MW=24,000 g/mol, on the complexing of the anti-inflammatory drug nabumetone, with {beta}-cyclodextrin ({beta}-CD). The data show that the polymer interacts with the free nabumetone and with the nabumetone:{beta}-CD inclusion complex, in both cases with a stoichiometry of 1:1. The interaction constants are 1.3x10{sup 4} M{sup -1} and 1.6x10{sup 4} M{sup -1}, respectively. The presence of PVP, changes the drug:cyclodextrin interaction, a nabumetone:({beta}-CD){sub 2}:PVP complex being formed. In addition, the presence of PVP, produces a strong increase in the global binding constant, {beta} {sub 2}=(22.12{+-}0.22)x10{sup 6} M{sup -2} at 1% PVP. In the ternary complex, the nabumetone is wrapped at both ends for the {beta}-CD. In this complex the polymer seems to act as a bridge between both {beta}-CD molecules that bind the nabumetone.

  4. The ternary metal mixed ligand complexes formed by benzimidazole and N, N-bis(2-hydroxyethyl) glycine

    Institute of Scientific and Technical Information of China (English)

    贺小凤; 龙腊生; 毋福海; 乐学义; 陈小明; 计亮年; 周忠远

    1999-01-01

    The stability constants of the ternary M(Bic)(Bzim)+ complexes, where M2+=Cu2+, Ni2+ or Zn2+, Bic-=the anion of N, N-bis(2-hydroxyethyl) glycine and Bzim = benzimidazole, were determined by potentiometric pH titration in aqueous solution. One of them (M2+ = Cu2+) was also separately determined by spectrophotometry. The results show that these ternary complexes are stabler than expected on statistical grounds. The enhanced stability of the ternary M(Bic) (Bzim)+ complexes is attributed to the πA-πB cooperative effect between Bic- and benzimidazole. Besides, compared with Cu(Bic) (Bzim)+ and Ni(Bic) (Bzim)+, the ternary Zn(Bic)(Bzim)+ complex has relatively high stability. The crystal structure of [Cu(Bic)(Bzim)]ClO4 was determined by single crystal X-ray diffraction techniques. The copper atom has a trigonal-bipyramidal geometry, the basal plane is formed by an oxygen atom of the carboxylato group and two hydroxyl oxygen atoms, the apical position is occupied by a nitrogen a

  5. Photocytotoxic ternary copper(II) complexes of histamine Schiff base and pyridyl ligands

    Indian Academy of Sciences (India)

    Samya Banerjee; Akanksha Dixit; K Sesha Maheswaramma; Basudev Maity; Sanjoy Mukherjee; Arun Kumar; Anjali A Karande; Akhil R Chakravarty

    2016-02-01

    Ternary copper(II) complexes of salicylaldehyde-histamine Schiff base (HL) and pyridyl ligands, viz. [Cu(bpy)(L)](ClO4) (1) and [Cu(dppz)(L)](ClO4) (2), where bpy is 2,2′-bipyridine (in 1) and dppz is dipyrido[3,2-a:2′,3′-c]phenazine (in 2), were synthesized, characterized and their DNA binding, photo-activated DNA cleavage activity and photocytotoxicity studied. The 1:1 electrolytic one-electron paramagnetic complexes showed a d-d band near 670 nm in aqueous DMF (1:1 v/v). The crystal structure of complex 1 showed the metal in CuN4O distorted square-pyramidal geometry. Complex 2 intercalatively binds to calf-thymus (ct) DNA with a binding constant (b) of ∼105 M−1. It exhibited moderate chemical nuclease activity but excellent DNA photocleavage activity in red light of 647 nm forming $^{\\bullet}\\text{OH}$ radicals. It showed remarkable photocytotoxicity in human cervical cancer cells (HeLa) giving IC50 of 1.6 M in visible light (400-700 nm) with low dark toxicity. The photo-induced cell death is via generation of oxidative stress by reactive oxygen species.

  6. Statistical thermodynamics of liquid-liquid phase separation in ternary systems during complex coacervation

    Science.gov (United States)

    Pawar, Nisha; Bohidar, H. B.

    2010-09-01

    Liquid-liquid phase separation leading to complex coacervation in a ternary system (oppositely charged polyion and macroion in a solvent) is discussed within the framework of a statistical thermodynamics model. The polyion and the macroion in the ternary system interact to form soluble aggregates (complexes) in the solvent, which undergoes liquid-liquid phase separation. Four necessary conditions are shown to drive the phase separation: (i) (σ23)3r/Φ23c≥((64)/(9α2))(χ23Φ3)2 , (ii) r≥[(64(χ23Φ3)2)/(9α2σ233)]1/2 , (iii) χ23≥((2χ231-1))/(Φ23cΦ3) , and (iv) (σ23)2/I≥(8)/(3α)(2χ231-1) (where σ23 is the surface charge on the complex formed due to binding of the polyelectrolyte and macroion, Φ23c is the critical volume fraction of the complex, χ23 is the Flory interaction parameter between polyelectrolyte and macroion, χ231 is the same between solvent and the complex, Φ3 is the volume fraction of the macroions, I is the ionic strength of the solution, α is electrostatic interaction parameter and r is typically of the order of molecular weight of the polyions). It has been shown that coacervation always requires a hydrated medium. In the case of a colloidal macroion and polyelectrolyte coacervation, molecular weight of polyelectrolyte must satisfy the condition r≥103Da to exhibit liquid-liquid phase separation. This model has been successfully applied to study the coacervation phenomenon observed in aqueous Laponite (macroion)-gelatin (polyion) system where it was found that the coacervate volume fraction, δΦ23˜χ2312 (where δΦ23 is the volume fraction of coacervates formed during phase separation). The free energy and entropy of this process have been evaluated, and a free-energy landscape has been drawn for this system that maps the pathway leading to phase separation.

  7. Effect of Phosphate on U(VI) Sorption to Montmorillonite: Ternary Complexation and Precipitation Barriers

    Energy Technology Data Exchange (ETDEWEB)

    Troyer, Lyndsay D.; Maillot, Fabien; Wang, Zheming; Wang, Zimeng; Mehta, Vrajesh; Giammar, Daniel; Catalano, Jeffrey G.

    2016-02-15

    Phosphate addition is a potential treatment method to lower the solubility of U(VI) in soil and groundwater systems by causing U(VI) phosphate precipitation as well as enhancing adsorption. Previous work has shown that iron oxide surfaces may facilitate the nucleation of U(VI) phosphate minerals and, that under weakly acidic conditions, phosphate also enhances U(VI) adsorption to such phases. Like iron oxides, clays are important reactive phases in the subsurface but little is known about the interaction of U(VI) and phosphate with these minerals. The effect of aqueous phosphate on U(VI) binding to Wyoming montmorillonite (SWy-2) in air-equilibrated systems was investigated. Equilibrium U(VI) uptake to montmorillonite was determined at pH 4, 6 and 8 at discrete initial phosphate concentrations between 0 and 100 μM. The observed behavior of U(VI) indicates a transition from adsorption to precipitation with increasing total uranium and phosphate concentrations at all pH values. At the highest phosphate concentration examined at each pH value, a barrier to U(VI) phosphate nucleation is observed. At lower concentrations, phosphate has no effect on macroscopic U(VI) adsorption. To assess the mechanisms of U(VI)-phosphate interactions on smectite surfaces, U(VI) speciation was investigated under selected conditions using laser-induced fluorescence spectroscopy (LIFS) and extended X-ray absorption fine-structure (EXAFS) spectroscopy. Samples above the precipitation threshold display EXAFS and LIFS spectral signatures consistent with the autunite family of U(VI) phosphate minerals. However, at lower U(VI) concentrations, changes in LIFS spectra upon phosphate addition suggest that U(VI)-phosphate ternary surface complexes form on the montmorillonite surface at pH 4 and 6 despite the lack of a macroscopic effect on adsorption. The speciation of solid-associated U(VI) below the precipitation threshold at pH 8 is dominated by U(VI)-carbonate surface complexes. This work

  8. Effect of phosphate on U(VI) sorption to montmorillonite: Ternary complexation and precipitation barriers

    Science.gov (United States)

    Troyer, Lyndsay D.; Maillot, Fabien; Wang, Zheming; Wang, Zimeng; Mehta, Vrajesh S.; Giammar, Daniel E.; Catalano, Jeffrey G.

    2016-02-01

    Phosphate addition is a potential treatment method to lower the solubility of U(VI) in soil and groundwater systems by causing U(VI) phosphate precipitation as well as enhancing adsorption. Previous work has shown that iron oxide surfaces may facilitate the nucleation of U(VI) phosphate minerals and, that under weakly acidic conditions, phosphate also enhances U(VI) adsorption to such phases. Like iron oxides, clays are important reactive phases in the subsurface but little is known about the interaction of U(VI) and phosphate with these minerals. The effect of aqueous phosphate on U(VI) binding to Wyoming montmorillonite (SWy-2) in air-equilibrated systems was investigated. Equilibrium U(VI) uptake to montmorillonite was determined at pH 4, 6 and 8 at discrete initial phosphate concentrations between 0 and 100 μM. The observed behavior of U(VI) indicates a transition from adsorption to precipitation with increasing total uranium and phosphate concentrations at all pH values. At the highest phosphate concentration examined at each pH value, a barrier to U(VI) phosphate nucleation is observed. At lower concentrations, phosphate has no effect on macroscopic U(VI) adsorption. To assess the mechanisms of U(VI)-phosphate interactions on smectite surfaces, U(VI) speciation was investigated under selected conditions using laser-induced fluorescence spectroscopy (LIFS) and extended X-ray absorption fine-structure (EXAFS) spectroscopy. Samples above the precipitation threshold display EXAFS and LIFS spectral signatures consistent with the autunite family of U(VI) phosphate minerals. However, at lower U(VI) concentrations, changes in LIFS spectra upon phosphate addition suggest that U(VI)-phosphate ternary surface complexes form on the montmorillonite surface at pH 4 and 6 despite the lack of a macroscopic effect on adsorption. The speciation of solid-associated U(VI) below the precipitation threshold at pH 8 is dominated by U(VI)-carbonate surface complexes. This work

  9. Active-state models of ternary GPCR complexes: determinants of selective receptor-G-protein coupling.

    Directory of Open Access Journals (Sweden)

    Ralf C Kling

    Full Text Available Based on the recently described crystal structure of the β2 adrenergic receptor--Gs-protein complex, we report the first molecular-dynamics simulations of ternary GPCR complexes designed to identify the selectivity determinants for receptor-G-protein binding. Long-term molecular dynamics simulations of agonist-bound β2AR-Gαs and D2R-Gαi complexes embedded in a hydrated bilayer environment and computational alanine-scanning mutagenesis identified distinct residues of the N-terminal region of intracellular loop 3 to be crucial for coupling selectivity. Within the G-protein, specific amino acids of the α5-helix, the C-terminus of the Gα-subunit and the regions around αN-β1 and α4-β6 were found to determine receptor recognition. Knowledge of these determinants of receptor-G-protein binding selectivity is essential for designing drugs that target specific receptor/G-protein combinations.

  10. Structure of an asymmetric ternary protein complex provides insight for membrane interaction.

    Science.gov (United States)

    Dempsey, Brian R; Rezvanpour, Atoosa; Lee, Ting-Wai; Barber, Kathryn R; Junop, Murray S; Shaw, Gary S

    2012-10-10

    Plasma membrane repair involves the coordinated effort of proteins and the inner phospholipid surface to mend the rupture and return the cell back to homeostasis. Here, we present the three-dimensional structure of a multiprotein complex that includes S100A10, annexin A2, and AHNAK, which along with dysferlin, functions in muscle and cardiac tissue repair. The 3.5 Å resolution X-ray structure shows that a single region from the AHNAK C terminus is recruited by an S100A10-annexin A2 heterotetramer, forming an asymmetric ternary complex. The AHNAK peptide adopts a coil conformation that arches across the heterotetramer contacting both annexin A2 and S100A10 protomers with tight affinity (∼30 nM) and establishing a structural rationale whereby both S100A10 and annexin proteins are needed in AHNAK recruitment. The structure evokes a model whereby AHNAK is targeted to the membrane surface through sandwiching of the binding region between the S100A10/annexin A2 complex and the phospholipid membrane.

  11. Mechanism of electron transfer reaction of ternary dipicolinatochromium(III) complex involving oxalate as secondary ligand

    Indian Academy of Sciences (India)

    Hassan Amroun Ewais; Iqbal Mohamed Ibrhium Ismail

    2013-09-01

    Mechanism of electron transfer reaction of ternary Mechanism of the oxidation of [CrIII(DPA)(OX)(H2O)]− (DPA = dipicolinate and OX = oxalate) by periodate in aqueous acidic medium has been studied spectrophotometrically over the pH range of 4.45-5.57 at different temperatures. The reaction is first order with respect to both [IO$^{−}_{4}$] and the complex concentration, and it obeys the following rate law: $$d[{\\text Cr}^{\\text{VI}}]/dt = k_6K_4K_6[{\\text IO}^−_4][{\\text{Cr}}^{\\text{III}}]_{\\text{T}}/\\{([H^+] + K_4) + (K_5[H+] + K_6K_4)[{\\text{IO}}^{−}_{4}]\\}.$$ The rate of the reaction increases with increasing pH due to the deprotonation equilibria of the complex. The experimental rate law is consistent with a mechanism in which the deprotonated form [CrIII(DPA)(OX)(OH)]2− is more reactive than the conjugated acid. It is proposed that electron transfer proceeds through an inner-sphere mechanism via coordination of IO$^{−}_{4}$ to chromium(III). Thermodynamic activation parameters were calculated using the transition state theory equation.dipicolinatochromium(III) complex involving oxalate as secondary ligand

  12. Faster Synthesis of Beta-Diketonate Ternary Europium Complexes: Elapsed Times & Reaction Yields

    Science.gov (United States)

    Lima, Nathalia B. D.; Silva, Anderson I. S.; Gerson, P. C.; Gonçalves, Simone M. C.; Simas, Alfredo M.

    2015-01-01

    β-diketonates are customary bidentate ligands in highly luminescent ternary europium complexes, such as Eu(β-diketonate)3(L)2, where L stands for a nonionic ligand. Usually, the syntheses of these complexes start by adding, to an europium salt such as EuCl3(H2O)6, three equivalents of β-diketonate ligands to form the complexes Eu(β-diketonate)3(H2O)2. The nonionic ligands are subsequently added to form the target complexes Eu(β-diketonate)3(L)2. However, the Eu(β-diketonate)3(H2O)2 intermediates are frequently both difficult and slow to purify by recrystallization, a step which usually takes a long time, varying from days to several weeks, depending on the chosen β-diketonate. In this article, we advance a novel synthetic technique which does not use Eu(β-diketonate)3(H2O)2 as an intermediate. Instead, we start by adding 4 equivalents of a monodentate nonionic ligand L straight to EuCl3(H2O)6 to form a new intermediate: EuCl3(L)4(H2O)n, with n being either 3 or 4. The advantage is that these intermediates can now be easily, quickly, and efficiently purified. The β-diketonates are then carefully added to this intermediate to form the target complexes Eu(β-diketonate)3(L)2. For the cases studied, the 20-day average elapsed time reduced to 10 days for the faster synthesis, together with an improvement in the overall yield from 42% to 69%. PMID:26710103

  13. Isolation and properties of transcribing ternary complexes of Escherichia coli RNA polymerase positioned at a single template base.

    Science.gov (United States)

    Levin, J R; Krummel, B; Chamberlin, M J

    1987-07-05

    We have studied the conditions needed for the formation of stable ternary complexes by Escherichia coli RNA polymerase using a procedure in which elongation by the majority of active enzyme molecules is halted at a specific template base. Stable complexes of this sort, containing RNA chains as short as 15 nucleotides, have been formed from three different promoter sites (T7 A1, lambda PL, and E. coli rrnB P1) using di- and trinucleotides as primers in reactions limited by the presence of only three of the nucleoside triphosphate substrates. The resulting ternary complexes can be stored for at least five days without loss in activity, and provide useful reagents and substrates for studies of the properties of RNA polymerases engaged in chain elongation and termination. At all three promoter sites abortive initiation, leading to synthesis and release of oligomers up to ten nucleotides, competes with productive initiation, leading to the formation of stable elongating complexes. Thus the relative instability of ternary RNA polymerase complexes bearing transcripts shorter than ten nucleotides may be a general feature of the transcription initiation reaction.

  14. Thermochemistry of the Ternary Complex Nd(Et2dtc)3(phen)

    Institute of Scientific and Technical Information of China (English)

    FAN,Xue-Zhong(樊学忠); CHEN,San-Ping(陈三平); GAO,Sheng-Li(高胜利); JIAO,Bao-Juan(焦宝娟); HU,Rong-Zu(胡荣祖); SHI,Qi-Zhen(史启祯)

    2004-01-01

    The ternary solid complex has been synthesized with sodium diethyldithiocarbamate (NaEt2dtc·3H2O),1,10-phenanthroline (o-phen·H2O) and hydrated neodymium chloride in absolute ethanol. The title complex was identified as the general formula of Nd(Et2dtc)3(phen) by chemical and elemental analyses. IR spectrum of the complex showed that the Nd3+ coordinated with six sulfur atoms of three NaEt2dtc and two nitrogen atoms of o-phen. It was assumed that the coordination number of Nd3+ is eight. The enthalpy change of liquid-phase reaction of formation, △rHm (1), was determined as (-12.274±0.050) Kj·mol-1 at 298.15 K by a microcalorimeter, the enthalpy change of the solid-phase reaction of formation, △rHm (s), was calculated as (149.069 ±0.314) Kj·mol-1on the basis of a thermochemical cycle. The thermodynamics of reaction of formation was studied by changing the temperature of liquid-phase reaction. The constant-volume combustion energy of the complex, △Cu, was determined as (-18674.22± 8.33) Kj·mol-1 by a precise rotating-bomb calorimeter at 298.15 K. Its standard enthalpy of combustion, △cHm and standard enthalpy of formation, △fHm , were calculated as (-18693.43 ± 8.33) Kj·mol-1and (- 47.03 ± 9.17) Kj·mol- 1, respectively.

  15. Thermochemistry of Ternary Complex Dy(Et2dtc)3(phen)

    Institute of Scientific and Technical Information of China (English)

    朱丽; 焦宝娟; 杨旭武; 帅琪; 高胜利; 史启祯

    2004-01-01

    The ternary solid complex was synthesized with sodium diethyldithiocarbamate (NaEt2dtc), 1,10-phenanthroline (phen) and low hydrated dysprosium chloride in absolute ethanol by improved method of reference. The title complex was identified as the general formula of Dy(Et2dtc)3(phen) by chemical and elemental analyses. IR spectrum of the complex shows that the Dy3+ coordinated with six sulfur atoms of three NaEt2dtc and two nitrogen atoms of phen. It is assumed that the coordination number of Dy3+ is eight.The enthalpy change of liquid-phase reaction of formation, ΔrHθm(l), is determined as (-19.091±0.015) kJ·mol-1 at 298.15 K by a microcalorimeter, and the enthalpy change of the solid-phase reaction of formation, ΔrHθm(s), is calculated as (139.641±0.482) kJ·mol-1 on the basis of a thermochemical cycle. The thermodynamic of reaction of formation was studied by changing the temperature of liquid-phase reaction. The constant-volume combustion energy of the complex, ΔcU, is determined as (-16730.21±9.25) kJ·mol-1 by a precise rotating-bomb calorimeter at 298.15 K. Its standard enthalpies of combustion, ΔcHθm, and standard enthalpies of formation, ΔfHθm, are calculated as (-16749.42±9.25) kJ·mol-1 and (-2019.68±10.19) kJ·mol-1, respectively.

  16. Molecular Dynamics of Rab7::REP1::GGTase-II Ternary Complex and Identification of Their Putative Drug Binding Sites.

    Science.gov (United States)

    Sindhu, Meenakshi; Saini, Vandana; Piplani, Sakshi; Kumar, A

    2013-01-01

    The structure-function correlation of membrane proteins have been a difficult task, particularly in context to transient protein complexes. The molecular simulation of ternary complex of Rab7::REP1::GGTase-II was carried out to understand the basic structural events occurring during the prenylation event of Rab proteins, using the software YASARA. The study suggested that the C-terminus of Rab7 has to be in completely extended conformation during prenylation to reach the active site of RabGGTase-II. Also, attempt was made to find putative drug binding sites on the ternary complex of Rab7::REP1::GGTase-II using Q-SiteFinder programme. The comprehensive consensus probe generated by the program revealed a total of 10 major pockets as putative drug binding sites on Rab7::REP:: GGTase-II ternary complex. These pockets were found on REP protein and GGTase protein subunits. The Rab7 was found to be devoid of any putative drug binding sites in the ternary complex. The phylogenetic analysis of 60 Rab proteins of human was carried out using PHYLIP and study indicated the close phylogenetic relationship between Rab7 and Rab9 proteins of human and hence with further in silico study, the present observations can be extrapolated to Rab9 proteins. The study paves a good platform for further experimental verifications of the findings and other in silico studies like identifying the potential drug targets by searching the putative drug binding sites, generating pharmacophoric pattern, searching or constructing suitable ligand and docking studies.

  17. Preparation and photoluminescence enhancement in terbium(III ternary complexes with β-diketone and monodentate auxiliary ligands

    Directory of Open Access Journals (Sweden)

    Devender Singh

    2016-12-01

    Full Text Available A series of new solid ternary complexes of terbium(III ion based on β-diketone ligand acetylacetone (acac and monodentate auxiliary ligands (aqua/urea/triphenylphosphineoxide/pyridine-N-oxide had been prepared. The structural characterizations of synthesized ternary compounds were studied by means of elemental analysis, infrared (IR, and proton nuclear magnetic resonance (NMR spectral techniques. The optical characteristics were investigated with absorption as well as photoluminescence spectroscopy. Thermal behavior of compounds was examined by TGA/DTA analysis and all metal complexes were found to have good thermal stability. The luminescence decay time of complexes were also calculated by monitoring at emission wavelength corresponding to 5D4 → 7F5 transition. A comparative inspection of the luminescent behavior of prepared ternary compounds was performed in order to determine the function of auxiliary ligands in the enhancement of luminescence intensity produced by central terbium(III ion. The color coordinates values suggested that compounds showed bright green emission in visible region in electromagnetic spectrum. Complexes producing green light could play a significant role in the fabrication of efficient light conversion molecular devices for display purposes and lightning systems.

  18. Electroluminescent properties of three ternary europium complexes with different phenanthroline derivatives

    Institute of Scientific and Technical Information of China (English)

    BIAN Zuqiang; GAO Deqing; GUAN Min; XIN Hao; LI Fuyou; HUANG Chunhui; WANG Kezhi; JIN Linpei

    2004-01-01

    Three ternary Eu(Ⅲ) complexes with general formula of Eu(DBM)3LN (DBM =dibenzoylmethanate, and LN (N= 1-3 ) stand for three different 1,1 0-phenanthroline derivatives)have been synthesized for vacuum deposition films-based electroluminescent devices. The complex Eu(DBM)3L3 (L3 = 2-phenyl-3-[3-(carbazol-9-yl)propyl]imidazo[4,5-f]1,10-phenanthroline) was designed with an effort to combine the electron-transporting phenanthroline platform and the hole-transporting carbazole group into one molecule expecting to improve both electron and hole transporting properties simultaneously. The results show that the variation of the neutral ligands in Eu(Ⅲ) mixed ligand complexes is a simple and effective approach to the improvement in the thermal stability, PL and EL properties of materials. A double-layer device with the configuration of ITO/TPD (50 nm)/Eu(DBM)3L3 (50 nm)/Mgo.9Ago.1 (200 nm)/Ag (100 nm)exhibited Eu(Ⅲ)-based pure red emission with a maximum brightness of 561 cd/m2 at 16 V, and an onset driving voltage of 8 V. A device with the configuration of ITO/TPD (50 nm)/[Eu(DBM)3L3(5 nm):BCP (5 nm)]4/BCP (20 nm)/AIQ (10 nm) Mgo.gAgo.1 (110 nm)/Ag (100 nm) gave high efficient and pure red light emission with a luminance of 1419 cd/m2.

  19. Formation of a Ternary Complex among NHERF1, β-Arrestin, and Parathyroid Hormone Receptor*

    Science.gov (United States)

    Klenk, Christoph; Vetter, Thorsten; Zürn, Alexander; Vilardaga, Jean-Pierre; Friedman, Peter A.; Wang, Bin; Lohse, Martin J.

    2010-01-01

    β-Arrestins are crucial regulators of G-protein coupled receptor (GPCR) signaling, desensitization, and internalization. Despite the long-standing paradigm that agonist-promoted receptor phosphorylation is required for β-arrestin2 recruitment, emerging evidence suggests that phosphorylation-independent mechanisms play a role in β-arrestin2 recruitment by GPCRs. Several PDZ proteins are known to interact with GPCRs and serve as cytosolic adaptors to modulate receptor signaling and trafficking. Na+/H+ exchange regulatory factors (NHERFs) exert a major role in GPCR signaling. By combining imaging and biochemical and biophysical methods we investigated the interplay among NHERF1, β-arrestin2, and the parathyroid hormone receptor type 1 (PTHR). We show that NHERF1 and β-arrestin2 can independently bind to the PTHR and form a ternary complex in cultured human embryonic kidney cells and Chinese hamster ovary cells. Although NHERF1 interacts constitutively with the PTHR, β-arrestin2 binding is promoted by receptor activation. NHERF1 interacts directly with β-arrestin2 without using the PTHR as an interface. Fluorescence resonance energy transfer studies revealed that the kinetics of PTHR and β-arrestin2 interactions were modulated by NHERF1. These findings suggest a model in which NHERF1 may serve as an adaptor, bringing β-arrestin2 into close proximity to the PTHR, thereby facilitating β-arrestin2 recruitment after receptor activation. PMID:20656684

  20. Formation of a ternary complex among NHERF1, beta-arrestin, and parathyroid hormone receptor.

    Science.gov (United States)

    Klenk, Christoph; Vetter, Thorsten; Zürn, Alexander; Vilardaga, Jean-Pierre; Friedman, Peter A; Wang, Bin; Lohse, Martin J

    2010-09-24

    β-Arrestins are crucial regulators of G-protein coupled receptor (GPCR) signaling, desensitization, and internalization. Despite the long-standing paradigm that agonist-promoted receptor phosphorylation is required for β-arrestin2 recruitment, emerging evidence suggests that phosphorylation-independent mechanisms play a role in β-arrestin2 recruitment by GPCRs. Several PDZ proteins are known to interact with GPCRs and serve as cytosolic adaptors to modulate receptor signaling and trafficking. Na(+)/H(+) exchange regulatory factors (NHERFs) exert a major role in GPCR signaling. By combining imaging and biochemical and biophysical methods we investigated the interplay among NHERF1, β-arrestin2, and the parathyroid hormone receptor type 1 (PTHR). We show that NHERF1 and β-arrestin2 can independently bind to the PTHR and form a ternary complex in cultured human embryonic kidney cells and Chinese hamster ovary cells. Although NHERF1 interacts constitutively with the PTHR, β-arrestin2 binding is promoted by receptor activation. NHERF1 interacts directly with β-arrestin2 without using the PTHR as an interface. Fluorescence resonance energy transfer studies revealed that the kinetics of PTHR and β-arrestin2 interactions were modulated by NHERF1. These findings suggest a model in which NHERF1 may serve as an adaptor, bringing β-arrestin2 into close proximity to the PTHR, thereby facilitating β-arrestin2 recruitment after receptor activation.

  1. Determination of tetracycline in milk by using nucleotide/lanthanide coordination polymer-based ternary complex.

    Science.gov (United States)

    Tan, Hongliang; Ma, Chanjiao; Song, Yonghai; Xu, Fugang; Chen, Shouhui; Wang, Li

    2013-12-15

    The meta-organic coordination polymers have been emerged as fascinating nanomaterials because of their tunable nature. In this work, we employed lanthanide coordination polymer self-assembled from adenosine monophosphate (AMP) and europium ion (Eu(3+)) as receptor reagent and citrate (Cit) as ancillary ligand to construct a fluorescent sensor for the detection of tetracycline (Tc) in milk. The co-coordination of Cit and Tc with Eu(3+) on the surface of the coordination polymer AMP/Eu leads to the formation of ternary complex which emitted strong fluorescence due to the removal of coordinated water molecules and an intramolecular energy transfer from Tc to Eu(3+). The fluorescent intensity of Eu(3+) displayed a good linear response to Tc concentrations in the range of 0.1-20 μM with a detection limit of 60 nM. This method was successfully applied to determine the levels of Tc in milk, which is the first application of coordination polymer as a fluorescent sensor in real sample. Compared with other Eu(3+)-based fluorescent methods for Tc detection, the presented method allows simple, direct analysis of Tc without requiring special reaction media or complicated prepreparation processes. This straightforward strategy could be extended to the preparation of other lanthanide coordination polymer-based fluorescent probes for applications in biosensing, imaging, drug delivery, and so on. Copyright © 2013 Elsevier B.V. All rights reserved.

  2. Structural characterization of the ternary complex that mediates termination of NF-κB signaling by IκBα.

    Science.gov (United States)

    Mukherjee, Sulakshana P; Quintas, Pedro O; McNulty, Reginald; Komives, Elizabeth A; Dyson, H Jane

    2016-05-31

    The transcription factor NF-κB is used in many systems for the transduction of extracellular signals into the expression of signal-responsive genes. Published structural data explain the activation of NF-κB through degradation of its dedicated inhibitor IκBα, but the mechanism by which NF-κB-mediated signaling is turned off by its removal from the DNA in the presence of newly synthesized IκBα (termed stripping) is unknown. Previous kinetic studies showed that IκBα accelerates NF-κB dissociation from DNA, and a transient ternary complex between NF-κB, its cognate DNA sequence, and IκBα was observed. Here we structurally characterize the >100-kDa ternary complex by NMR and negative stain EM and show a modeled structure that is consistent with the measurements. These data provide a structural basis for previously unidentified insights into the molecular mechanism of stripping.

  3. A TDG/CBP/RARα Ternary Complex Mediates the Retinoic Acid-dependent Expression of DNA Methylation-sensitive Genes

    Directory of Open Access Journals (Sweden)

    Hélène Léger

    2014-02-01

    Full Text Available The thymine DNA glycosylase (TDG is a multifunctional enzyme, which is essential for embryonic development. It mediates the base excision repair (BER of G:T and G:U DNA mismatches arising from the deamination of 5-methyl cytosine (5-MeC and cytosine, respectively. Recent studies have pointed at a role of TDG during the active demethylation of 5-MeC within CpG islands. TDG interacts with the histone acetylase CREB-binding protein (CBP to activate CBP-dependent transcription. In addition, TDG also interacts with the retinoic acid receptor α (RARα, resulting in the activation of RARα target genes. Here we provide evidence for the existence of a functional ternary complex containing TDG, CBP and activated RARα. Using global transcriptome profiling, we uncover a coupling of de novo methylation-sensitive and RA-dependent transcription, which coincides with a significant subset of CBP target genes. The introduction of a point mutation in TDG, which neither affects overall protein structure nor BER activity, leads to a significant loss in ternary complex stability, resulting in the deregulation of RA targets involved in cellular networks associated with DNA replication, recombination and repair. We thus demonstrate for the first time a direct coupling of TDG’s epigenomic and transcription regulatory function through ternary complexes with CBP and RARα.

  4. Potentiometric studies on ternary complexes involving some divalent transition metal ions, gallic acid and biologically abundant aliphatic dicarboxylic acids in aqueous solutions

    Directory of Open Access Journals (Sweden)

    Abdelatty Mohamed Radalla

    2015-06-01

    Full Text Available Formation of binary and ternary complexes of the divalent transition metal ions, Cu2+, Ni2+, Co2+ and Zn2+ with gallic acid and the biologically important aliphatic dicarboxylic acids (adipic, succinic, malic, malonic, maleic, tartaric and oxalic acids were investigated by means of the potentiometric technique at 25 °C and I = 0.10 mol dm−3 NaNO3. The acid-base properties of the ligands were investigated and discussed. The acidity constants of gallic acid and aliphatic dicarboxylic acids were determined and used for determining the stability constants of the binary and ternary complexes formed in the aqueous medium under the above experimental conditions. The formation of the different 1:1 and 1:2 binary complexes and 1:1:1 ternary complexes are inferred from the corresponding potentiometric pH-metric titration curves. The ternary complex formation was found to occur in a stepwise manner. The stability constants of these binary and ternary systems were calculated. The values of Δ log K, percentage of relative stabilization (%R.S. and log X were evaluated and discussed. The concentration distribution of the various complex species formed in solution was evaluated and discussed. The mode of chelation of ternary complexes formed was ascertained by conductivity measurements.

  5. Electroluminescent properties of three ternary europium complexes with different phenanthroline derivatives

    Institute of Scientific and Technical Information of China (English)

    BIAN; Zuqiang; GAO; Deqing; GUAN; Min; XIN; Hao; LI; Fuyou

    2004-01-01

    europium complexes for light-emitting diodes, Chem. Mater., 2000, 12:2537-2541.[13]Gao, X. C., Cao, H., Huang, C. H. et al., Electroluminescence of a novel terbium complex, Appl. Phys. Lett., 1998, 72: 2217-2219.[14]Archer, D., Chen, H., Thompson, L. C., Synthesis, characterization, and luminescence of europium(Ⅲ) Schiff base complexes,Inorg. Chem., 1998, 37: 2089-2095.[15]Haas, Y., Stein, G., Pathways of radiative and radiationless transitions in europium (111) solutions: Role of solvents and anions, J.Phys. Chem., 1971, 75: 3668-3677.[16]Hiort, C., Lincoln, P., Norden, B., DNA binding of A- and A[Ru(phen)2DPPZ]2+, J. Am. Chem. Soc., 1993, 115: 3448-3454.[17]Steck, E. A., Day, A. R., Reactions of phenanthraquinone and retenequinone with aldehydes and ammonium acetate in acetic acid solution, J. Am. Chem. Soc., 1943, 65: 452-456.[18]Bian, Z. Q., Wang, K. Z., Jin, L. P., Syntheses, spectroscopic and crystal structural studies of novel imidazo [4,5-f]1,10-phenanthroline derivatives and their Eu(Ⅲ) ternary complexes with dibenzoylmethane, Polyhedron, 2002, 21 (3): 313-319.[19]Guan, M., Bian, Z. Q., Xin, H. et al., Bright red light-emitting electroluminescence devices based on a novel carbazole-functionalized europium complex, New. J. Chem., 2003, 27: 1731-1734.

  6. Analysis of the phase solubility diagram of a phenacetin/competitor/beta-cyclodextrin ternary system, involving competitive inclusion complexation.

    Science.gov (United States)

    Ono, N; Hirayama, F; Arima, H; Uekama, K

    2001-01-01

    The competitive inclusion complexations in the ternary phenacetin/competitors/beta-cyclodextrin (beta-CyD) systems were investigated by the solubility method, where m-bromobenzoic acid (m-BBA) and o-toluic acid (o-TA) were used as competitors. The solubility changes of the drug and competitors as a function of beta-CyD concentration in the ternary systems were formulated using their stability constants and intrinsic solubilities. The decrease in solubility of phenacetin by the addition of competitors could be quantitatively simulated by the formulation, when both drug and competitor give A(L) type solubility diagrams. On the other hand, when one of the guests gives a B(S) type solubility diagram, its solubility change was clearly reflected in that of the another guest, i.e., phenacetin gave an A(L) type solubility diagram in the binary phenacetin/beta-CyD system and o-TA gave a B(S) type diagram in the binary o-TA/beta-CyD system, but in the ternary phenacetin/o-TA/beta-CyD system, a new plateau region appeared in the original A(L) type diagram of phenacetin. This was explained by the solubilization theory of Higuchi and Connors. The solubility analysis of the ternary drug/competitor/CyD systems may be particularly useful for determination of the stability constant of a drug whose physicochemical and spectroscopic analyses are difficult, because they can be calculated by monitoring the solubility change of a competitor, without monitoring that of a drug. Furthermore, the present results suggest that attention should be paid to the type of the phase solubility diagram, as well as the magnitude of the stability constant and the solubility of the complex, for a rational formulation design of CyD complexes.

  7. Validation of quantitative analysis method for triamcinolone in ternary complexes by UV-Vis spectrophotometry

    Directory of Open Access Journals (Sweden)

    GEORGE DARLOS A. AQUINO

    2011-06-01

    Full Text Available Triamcinolone (TRI, a drug widely used in the treatment of ocular inflammatory diseases, is practically insoluble in water, which limits its use in eye drops. Cyclodextrins (CDs have been used to increase the solubility or dissolution rate of drugs. The purpose of the present study was to validate a UV-Vis spectrophotometric method for quantitative analysis of TRI in inclusion complexes with beta-cyclodextrin (B-CD associated with triethanolamine (TEA (ternary complex. The proposed analytical method was validated with respect to the parameters established by the Brazilian regulatory National Agency of Sanitary Monitoring (ANVISA. The analytical measurements of absorbance were made at 242nm, at room temperature, in a 1-cm path-length cuvette. The precision and accuracy studies were performed at five concentration levels (4, 8, 12, 18 and 20μg.mL-1. The B-CD associated with TEA did not provoke any alteration in the photochemical behavior of TRI. The results for the measured analytical parameters showed the success of the method. The standard curve was linear (r2 > 0.999 in the concentration range from 2 to 24 μg.mL-1. The method achieved good precision levels in the inter-day (relative standard deviation-RSD <3.4% and reproducibility (RSD <3.8% tests. The accuracy was about 80% and the pH changes introduced in the robustness study did not reveal any relevant interference at any of the studied concentrations. The experimental results demonstrate a simple, rapid and affordable UV-Vis spectrophotometric method that could be applied to the quantitation of TRI in this ternary complex. Keywords: Validation. Triamcinolone. Beta-cyclodextrin. UV- Vis spectrophotometry. Ternary complexes. RESUMO Validação de método de análise quantitativa para a triancinolona a partir de complexo ternário por espectrofotometria de UV-Vis A triancinolona (TRI é um fármaco amplamente utilizado no tratamento de doenças inflamatórias do globo ocular e

  8. Synthesis and Characterization of Eu4(PMA)3(phen)0.75·7H2O Ternary Luminescent Complex

    Institute of Scientific and Technical Information of China (English)

    2006-01-01

    Eu(Ⅲ)-Pyromellitic acid[PMA]-1,10-phenanthroline (phen) ternary luminescent complex was prepared in ethanol and water mixed solvent. The elemental analysis, inductively coupled plasma-atomic emission spectroscopy (ICP-AES) fourier-transform infrared spectroscopy (FT-IR) indicates that its chemical constitution is Eu4(PMA)3(phen)0.75·7H2O. TG-DTA curves indicated that the complex is heat stable at the temperature of 430 ℃. The XRD patterns showed that the complex is a new crystal different from the two ligands' structures. SEM image indicates that the complex is in block shape and disperses well. Photoluminescence (PL) analysis indicates that the complex emits Eu3+ characteristic luminescence under ultraviolet excitation.

  9. Rotational-echo double-resonance NMR-restrained model of the ternary complex of 5-enolpyruvylshikimate-3-phosphate synthase

    Energy Technology Data Exchange (ETDEWEB)

    McDowell, Lynda M. [Washington University, One, Department of Chemistry (United States)], E-mail: mcdowell@wuchem.wustl.edu; Poliks, Barbara [Binghamton University, Department of Physics (United States); Studelska, Daniel R. [Washington University School of Medicine, Department of Pathology and Immunology (United States); O' Connor, Robert D. [Washington University, One, Department of Chemistry (United States); Beusen, Denise D.; Schaefer, Jacob [Washington University, One, Department of Chemistry (United States)

    2004-01-15

    The 46-kD enzyme 5-enolpyruvylshikimate-3-phosphate (EPSP) synthase catalyzes the condensation of shikimate-3-phosphate (S3P) and phosphoenolpyruvate to form EPSP. The reaction is inhibited by N-(phosphonomethyl)-glycine (Glp), which, in the presence of S3P, binds to EPSP synthase to form a stable ternary complex. We have used solid-state NMR and molecular modeling to characterize the EPSP synthase-S3P-Glp ternary complex. Modeling began with the crystal coordinates of the unliganded protein, published distance restraints, and information from the chemical modification and mutagenesis literature on EPSP synthase. New inter-ligand and ligand-protein distances were obtained. These measurements utilized the native {sup 31}P in S3P and Glp, biosynthetically {sup 13}C-labeled S3P, specifically {sup 13}C and {sup 15}N labeled Glp, and a variety of protein-{sup 15}N labels. Several models were investigated and tested for accuracy using the results of both new and previously published rotational-echo double resonance (REDOR) NMR experiments. The REDOR model is compared with the recently published X-ray crystal structure of the ternary complex, PDB code 1G6S. There is general agreement between the REDOR model and the crystal structure with respect to the global folding of the two domains of EPSP synthase and the relative positioning of S3P and Glp in the binding pocket. However, some of the REDOR data are in disagreement with predictions based on the coordinates of 1G6S, particularly those of the five arginines lining the binding site. We attribute these discrepancies to substantive differences in sample preparation for REDOR and X-ray crystallography. We applied the REDOR restraints to the 1G6S coordinates and created a REDOR-refined xray structure that agrees with the NMR results.

  10. Synthesis, Crystal Structure, and Characterization of Ternary Copper(II Complex Derived from N-(salicylidene-L-valine

    Directory of Open Access Journals (Sweden)

    Sundaramurthy Santha Lakshmi

    2016-01-01

    Full Text Available Ternary Schiff base copper(II complex [CuL(tmpda] (where H2L is N-(salicylidene-L-valine; tmpda is N,N,N′,N′-tetramethyl-1,3-propanediamine has been characterized by UV-Vis., FTIR, and single crystal XRD. The crystal structure displays a distorted square pyramidal geometry in which Schiff base is bonded to the Cu(II ion via phenolate oxygen, imine nitrogen, and an oxygen atom of the carboxylate group through the basal plane and the chelating diamine, N,N,N′,N′-tetramethyl-1,3-propanediamine, displays an axial and equatorial mode of binding via NN-donor atoms.

  11. Synthesis and photoluminescent properties of doped ternary Eu_(1-x)Ln_x(NPPD)_3·DPQ complexes

    Institute of Scientific and Technical Information of China (English)

    李月琴; 李烨; 徐慧华; 陶弦; 张冬梅; 沈应中

    2010-01-01

    Rare earth (RE) ternary complexes of Eu0.5Ln0.5(NPPD)3·(DPQ) (HNPPD=1-(naphthalen-2-yl)-3-phenylpropane-1,3-dione; DPQ= dipyridobenzoquinone) and Eu1-xLax(NPPD)3·(DPQ) (Ln3+=La3+, Gd3+, Sm3+, Pr3+; x=0.0, 0.1, 0.3, 0.5, 0.7, 0.9) were synthesized by the reaction of RECl3·6H2O with HNPPD and DPQ in stoichiometry. The complexes were characterized with IR, elemental analysis, TGA-DSC and wide-angle X-ray diffraction. The UV-Vis absorption spectra and fluorescence properties of the complexes were also investiga...

  12. Ternary fission

    Indian Academy of Sciences (India)

    M Balasubramaniam; K R Vijayaraghavan; C Karthikraj

    2015-09-01

    We present the ternary fission of 252Cf and 236U within a three-cluster model as well as in a level density approach. The competition between collinear and equatorial geometry is studied by calculating the ternary fragmentation potential as a function of the angle between the lines joining the stationary middle fragment and the two end fragments. The obtained results for the 16O accompanying ternary fission indicate that collinear configuration is preferred to equatorial configuration. Further, for all the possible third fragments, the potential energy surface (PES) is calculated corresponding to an arrangement in which the heaviest and the lightest fragments are considered at the end in a collinear configuration. The PES reveals several possible ternary modes including true ternary modes where the three fragments are of similar size. The complete mass distributions of Si and Ca which accompanied ternary fission of 236U is studied within a level density picture. The obtained results favour several possible ternary combinations.

  13. Synthesis of novel binary and ternary Zn2+ complexes with putrescine and phosphocreatine and the metal complexes study in aqueous solution

    Science.gov (United States)

    Szyfman, Natalie Waissmann; Tenório, Thaís; Ribeiro, Tatiana S.; Felcman, Judith; Mercê, Ana Lucia Ramalho

    2014-09-01

    Binary and ternary systems of Zn2+ complexes with phosphocreatine (PCr) and putrescine (Put) were investigated in aqueous solution using potentiometric titrations, Raman spectroscopy, Nuclear Magnetic Resonance (1H NMR) and molecular modeling. The stability constants of the complexes and molecular adducts, determined by potentiometry (T = 25.0 °C, I = 0.100 mol L-1, KNO3), are for some of the calculated complexes log KZnPCr = 10.63 ± 0.03, log KZnPut = 5.22 ± 0.08 and for log KZnPCrPut = 16.56 ± 0.02. PCr acts as a bidentate ligand and Put as a monodentate ligand until around pH 11. The Raman and 1H NMR spectra and minimum total molecular energies calculations confirm the coordination modes of all systems. The ternary species are suggested by the values of the stability constants found as, when compared to those of the binary complexes with each ligand, they are neither the sum of the two or a value less than each one separately complexed with Zn2+. An intermolecular interaction was suggested for the ZnPCrPut species. However, for ZnPCrPutH species it was not possible to establish the same kind of interaction due to the long distance between the carboxylate group of phosphocreatine and the NH3+ group of Put.

  14. Functional Insights into Human HMG-CoA Lyase from Structures of Acyl-CoA-containing Ternary Complexes

    Energy Technology Data Exchange (ETDEWEB)

    Fu, Zhuji; Runquist, Jennifer A.; Montgomery, Christa; Miziorko, Henry M.; Kim, Jung-Ja P. (MCW); (UMKC)

    2010-08-16

    HMG-CoA lyase (HMGCL) is crucial to ketogenesis, and inherited human mutations are potentially lethal. Detailed understanding of the HMGCL reaction mechanism and the molecular basis for correlating human mutations with enzyme deficiency have been limited by the lack of structural information for enzyme liganded to an acyl-CoA substrate or inhibitor. Crystal structures of ternary complexes of WT HMGCL with the competitive inhibitor 3-hydroxyglutaryl-CoA and of the catalytically deficient HMGCL R41M mutant with substrate HMG-CoA have been determined to 2.4 and 2.2 {angstrom}, respectively. Comparison of these {beta}/{alpha}-barrel structures with those of unliganded HMGCL and R41M reveals substantial differences for Mg{sup 2+} coordination and positioning of the flexible loop containing the conserved HMGCL 'signature' sequence. In the R41M-Mg{sup 2+}-substrate ternary complex, loop residue Cys{sup 266} (implicated in active-site function by mechanistic and mutagenesis observations) is more closely juxtaposed to the catalytic site than in the case of unliganded enzyme or the WT enzyme-Mg{sup 2+}-3-hydroxyglutaryl-CoA inhibitor complex. In both ternary complexes, the S-stereoisomer of substrate or inhibitor is specifically bound, in accord with the observed Mg{sup 2+} liganding of both C3 hydroxyl and C5 carboxyl oxygens. In addition to His{sup 233} and His{sup 235} imidazoles, other Mg{sup 2+} ligands are the Asp{sup 42} carboxyl oxygen and an ordered water molecule. This water, positioned between Asp{sup 42} and the C3 hydroxyl of bound substrate/inhibitor, may function as a proton shuttle. The observed interaction of Arg{sup 41} with the acyl-CoA C1 carbonyl oxygen explains the effects of Arg{sup 41} mutation on reaction product enolization and explains why human Arg{sup 41} mutations cause drastic enzyme deficiency.

  15. Modeling the ternary complex TCR-Vbeta/CollagenII(261-273/HLA-DR4 associated with rheumatoid arthritis.

    Directory of Open Access Journals (Sweden)

    Maria Cristina De Rosa

    Full Text Available BACKGROUND: It is known that genetic predisposition to rheumatoid arthritis (RA is associated with the MHC class II allele HLA-DR4 and that residues 261-273 of type II collagen (huCollp261 represent an immunodominant T cell epitope restricted by the DR4 molecule. Despite recent advances in characterization of MHC and T cell receptor (TCR contacts to this epitope, the atomic details of TCR/huCollp261/HLA-DR4 ternary complex are not known. METHODOLOGY/PRINCIPAL FINDINGS: Here we have used computational modeling to get insight into this interaction. A three-dimensional model of the TCR Vbeta domain from a DR4(+ patient affected by RA has been derived by homology modeling techniques. Subsequently, the structure of the TCR Vbeta domain in complex with huCollp261/HLA-DR4 was obtained from a docking approach in conjunction with a filtering procedure based on biochemical information. The best complex from the docking experiments was then refined by 20 ns of molecular dynamics simulation in explicit water. The predicted model is consistent with available experimental data. Our results indicate that residues 97-101 of CDR3beta are critical for recognition of huCollp261/HLA-DR4 by TCR. We also show that TCR contacts on p/MHC surface affect the conformation of the shared epitope expressed by DR alleles associated with RA susceptibility. CONCLUSIONS/SIGNIFICANCE: This work presents a three-dimensional model for the ternary complex TCR-Vbeta/collagenII(261-273/HLA-DR4 associated with rheumatoid arthritis that can provide insights into the molecular mechanisms of self reactivity.

  16. The Ternary Complex of PrnB (the Second Enzyme in the Pyrrolnitrin Biosynthesis Pathway), Tryptophan, and Cyanide Yields New Mechanistic Insights into the Indolamine Dioxygenase Superfamily*

    Science.gov (United States)

    Zhu, Xiaofeng; van Pée, Karl-Heinz; Naismith, James H.

    2010-01-01

    Pyrrolnitrin (3-chloro-4-(2′-nitro-3′-chlorophenyl)pyrrole) is a broad-spectrum antifungal compound isolated from Pseudomonas pyrrocinia. Four enzymes (PrnA, PrnB, PrnC, and PrnD) are required for pyrrolnitrin biosynthesis from tryptophan. PrnB rearranges the indole ring of 7-Cl-l-tryptophan and eliminates the carboxylate group. PrnB shows robust activity in vivo, but in vitro activity for PrnB under defined conditions remains undetected. The structure of PrnB establishes that the enzyme belongs to the heme b-dependent indoleamine 2,3-dioxygenase (IDO) and tryptophan 2,3-dioxygenase (TDO) family. We report the cyanide complex of PrnB and two ternary complexes with both l-tryptophan or 7-Cl-l-tryptophan and cyanide. The latter two complexes are essentially identical and mimic the likely catalytic ternary complex that occurs during turnover. In the cyanide ternary complexes, a loop previously disordered becomes ordered, contributing to the binding of substrates. The conformations of the bound tryptophan substrates are changed from that seen previously in the binary complexes. In l-tryptophan ternary complex, the indole ring now adopts the same orientation as seen in the PrnB binary complexes with other tryptophan substrates. The amide and carboxylate group of the substrate are orientated in a new conformation. Tyr321 and Ser332 play a key role in binding these groups. The structures suggest that catalysis requires an l-configured substrate. Isothermal titration calorimetry data suggest d-tryptophan does not bind after cyanide (or oxygen) coordinates with the distal (or sixth) site of heme. This is the first ternary complex with a tryptophan substrate of a member of the tryptophan dioxygenase superfamily and has mechanistic implications. PMID:20421301

  17. A model for the unique role of factor Va A2 domain extension in the human ternary thrombin-generating complex.

    Science.gov (United States)

    Shim, Joong-Youn; Lee, Chang Jun; Wu, Sangwook; Pedersen, Lee G

    2015-04-01

    An all-atom human ternary model for the prothrombinase-prothrombin complex, including metal ions and post-translationally modified residues, was constructed from existing X-ray crystal structures. The factor Xa-prothrombin interface was taken from an existing ternary model, which locates the active site of factor Xa in the vicinity of prothrombin cleavage positions. The three sulfotyrosine residues at the C-terminal sequence of factor Va A2 domain are accommodated by modelling rational interactions with positively charged patches on the surface of prothrombin. The entire model is then solvent-equilibrated with molecular dynamics. This ternary model for the thrombin-generating complex provides an estimate as to the role of the C-terminus of the factor Va A2 domain: to establish an interface between FXa and prothrombin and to stabilize the orientation of this interface. Copyright © 2015 Elsevier B.V. All rights reserved.

  18. New binary and ternary platinum(II) formamidine complexes: Synthesis, characterization, structural studies and in-vitro antitumor activity

    Science.gov (United States)

    Soliman, Ahmed A.; Alajrawy, Othman I.; Attaby, Fawzy A.; Linert, W.

    2016-07-01

    A series of new binary and ternary platinum(II) complexes of the type [Pt(L1-4)Cl2].xH2O and [Pt(L1-4)ox].xH2O where L = formamidine ligands and ox = oxalate, have been synthesized and characterized by elemental analyses, magnetic susceptibility, UV-vis, infrared (IR), mass spectroscopy, thermal analysis and theoretical calculations. The spectroscopic data indicated that the formamidine ligands act as bidentate N2 donors. The complexes (1-8) are diamagnetic and the optimization of their structures indicated that the geometry is distorted square planar with Cl-Pt-Cl, O-Pt-O and N-Pt-N bond angles ranged 81.73°-95.82° which is acceptable for the heteroleptic complexes. The electronic energies (a.u.) of the complexes (-893.53 to -1989.84) indicate that the complexes are more stable than the ligands. The energies of the HOMO (-0.218 to -0.244) and LUMO (-.0111to -0.134) orbitals of the complexes were negative which indicates that the complexes are stable compounds. The dipole moment of the complexes (6.23-19.89 Debye) indicates that the complexes are polarized. The complexes are thermally stable as shown from their relatively higher overall activation energies (889-2066 kJ mol-1). The complexes are proved to have a good cytotoxicity with IC50 (μM) against MCF-7 (0.040-0.117), HCT-116 (0.085-0.119) and HepG-2 (0.058-0.131) cell lines, which open the field for further application as antitumor compounds.

  19. Synthesis, characteristics and luminescent properties of a new Tb(III) ternary complex applied in near UV-based LED

    Science.gov (United States)

    Sun, Naiqun; Li, Liping; Yang, Yamin; Zhang, Aiqin; Jia, Husheng; Liu, Xuguang; Xu, Bingshe

    2015-11-01

    A novel Tb(III) ternary complex, Tb(p-BBA)3UA, was synthesized with 4-benzoylbenzoic acid (p-BBA) as primary ligand and undecylenic acid (UA) as reactive ligand. Tb(III) complex exhibits high thermal stability and wide and strong excitation bands from 310 nm to 400 nm when monitored at 543 nm, which matches well with the 365 nm UV chip. The complex displays Tb(III) characteristic peaks at 488, 543, 584 and 619 nm under the excitation of 365 nm UV-light. The intramolecular energy transfer process was also discussed. Meanwhile, the complex has longer fluorescence lifetime (1.317 ms) and higher quantum yield (44.8%). When used in LED with 365 nm UV chip (power efficiency is 17.3 lm/W), the complex still maintained its qualified luminescent performance. All the results indicate that Tb(p-BBA)3UA can be applied as a green component for fabrication of near UV-based white LED.

  20. Visible-near-infrared luminescent lanthanide ternary complexes based on beta-diketonate using visible-light excitation.

    Science.gov (United States)

    Sun, Lining; Qiu, Yannan; Liu, Tao; Feng, Jing; Deng, Wei; Shi, Liyi

    2015-11-01

    We used the synthesized dinaphthylmethane (Hdnm) ligand whose absorption extends to the visible-light wavelength, to prepare a family of ternary lanthanide complexes, named as [Ln(dnm)3 phen] (Ln = Sm, Nd, Yb, Er, Tm, Pr). The properties of these complexes were investigated by Fourier transform infrared (FT-IR) spectroscopy, diffuse reflectance (DR) spectroscopy, thermogravimetric analyses, and excitation and emission spectroscopy. Generally, excitation with visible light is much more advantageous than UV excitation. Importantly, upon excitation with visible light (401-460 nm), the complexes show characteristic visible (Sm(3+)) as well as near-infrared (Sm(3+), Nd(3+), Yb(3+), Er(3+), Tm(3+), Pr(3+)) luminescence of the corresponding lanthanide ions, attributed to the energy transfer from the ligands to the lanthanide ions, an antenna effect. Now, using these near-infrared luminescent lanthanide complexes, the luminescent spectral region from 800 to 1650 nm, can be covered completely, which is of particular interest for biomedical imaging applications, laser systems, and optical amplification applications.

  1. Crystal structure of a complete ternary complex of T-cell receptor, peptide-MHC, and CD4

    Energy Technology Data Exchange (ETDEWEB)

    Yin, Yiyuan; Wang, Xin Xiang; Mariuzza, Roy A [Maryland

    2012-07-11

    Adaptive immunity depends on specific recognition by a T-cell receptor (TCR) of an antigenic peptide bound to a major histocompatibility complex (pMHC) molecule on an antigen-presenting cell (APC). In addition, T-cell activation generally requires binding of this same pMHC to a CD4 or CD8 coreceptor. Here, we report the structure of a complete TCR-pMHC-CD4 ternary complex involving a human autoimmune TCR, a myelin-derived self-peptide bound to HLA-DR4, and CD4. The complex resembles a pointed arch in which TCR and CD4 are each tilted ~65° relative to the T-cell membrane. By precluding direct contacts between TCR and CD4, the structure explains how TCR and CD4 on the T cell can simultaneously, yet independently, engage the same pMHC on the APC. The structure, in conjunction with previous mutagenesis data, places TCR-associated CD3εγ and CD3εδ subunits, which transmit activation signals to the T cell, inside the TCR-pMHC-CD4 arch, facing CD4. By establishing anchor points for TCR and CD4 on the T-cell membrane, the complex provides a basis for understanding how the CD4 coreceptor focuses TCR on MHC to guide TCR docking on pMHC during thymic T-cell selection.

  2. Effect of halogen substitutions on dUMP to stability of thymidylate synthase/dUMP/mTHF ternary complex using molecular dynamics simulation.

    Science.gov (United States)

    Kaiyawet, Nopporn; Rungrotmongkol, Thanyada; Hannongbua, Supot

    2013-06-24

    The stability of the thymidylate synthase (TS)/2-deoxyuridine-5-monophosphate (dUMP)/5,10-methylene-5,6,7,8-tetrahydrofolate (mTHF) ternary complex formation and Michael addition are considered as important steps that are involved in the inhibition mechanism of the anticancer prodrug 5-fluorouracil (5-FU). Here, the effect of three different halogen substitutions on the C-5 position of the dUMP (XdUMPs = FdUMP, CldUMP, and BrdUMP), the normal substrate, on the stability of the TS/dUMP and TS/dUMP/mTHF binary and ternary complexes, respectively, was investigated via molecular dynamics simulation. The simulated results revealed that the stability of all the systems was substantially increased by mTHF binding to the catalytic pocket. In the ternary complex, a much greater stabilization of the dUMP and XdUMPs through electrostatic interactions, including charge-charge and hydrogen bond interactions, was found compared to mTHF. An additional unique hydrogen bond between the substituted fluorine of FdUMP and the hydroxyl group of the TS Y94 residue was observed in both the binary and ternary complexes. The distance between the S(-) atom of the TS C146 residue and the C6 atom of dUMP, at dUMP is substituted by a halogen atom. The MM/PBSA binding free energy revealed the significant role of the bridging waters around the ligands in the increased binding affinity (∼10 kcal/mol) of dUMP/XdUMP, either alone or together with mTHF, toward TS. The order of the averaged binding affinity in the ternary systems was found to be CldUMP ≈ FdUMP > dUMP > BrdUMP, suggesting that CldUMP could be a potent candidate TS inhibitor, the same as FdUMP (the metabolite form of 5-FU).

  3. Synthesis and Crystal Structure of a Ternary Complex: [Ni(phen)2(pmal)]·8H2O

    Institute of Scientific and Technical Information of China (English)

    GAO En-Jun; YU Ying; WANG Ke-Hua; SNN Ya-Guang; LI Hao-Yang

    2006-01-01

    A new ternary complex [Ni(phen)(pmal)]·8H2O (phen = 1,10-phenanthroline,pmal2- = phenethyl malonic acid) has been synthesized by the reaction of nickel acetate, phen and phenethyl malonic acid. Elemental analysis, IR spectra and X-ray single-crystal diffraction were carried out to determine the composition and crystal structure. Crystal data for this complex: triclinic system, space group P1, a = 10.387(5), b = 13.112(6), c = 14.229(6) (A), α = 76.176(7), β =83.778(8), y = 71.770(6)°, C35H42N4O12Ni, Mr= 769.44, Z = 2, F(000) = 808, V = 1786.1 (A)3, Dc =1.431 g/cm3, μ = 0.612 mm-1, the final R = 0.0653 and wR = 0.1033 for 9379 (Rint = 0.0244)independent reflections and 4730 observed reflections (I > 2σ(I)). Structural analysis shows that the coordination geometry of Ni(Ⅱ) is a distorted octahedron. A novel two-dimensional structure is constructed from (H2O)4 and (H2O)12 water clusters, and the complex forms a 3-D network supramolecular structure by hydrogen bonds and π-π stacking of neighboring phens.

  4. Fac-mer equilibria of coordinated iminodiacetate (ida2-) in ternary CuII(ida)(H-1B)- complex formation (B = imidazole, benzimidazole) in aqueous solution

    Indian Academy of Sciences (India)

    Susmita Bandyopadhyay; G N Mukherjee

    2003-08-01

    pH potentiometric and spectrophotometric investigations on the complex formation equilibria of CuII with iminodiacetate (ida2-) and heterocyclic N-bases, viz. imidazole and benzimidazole (B), in aqueous solution in binary and ternary systems using different molar ratios of the reactants indicated the formation of complexes of the types, Cu(ida), Cu(ida)(OH)-, (ida)Cu(OH)Cu(ida)-, Cu(B)2+, Cu(H-1B)+, Cu(ida)(H-1B)-, (ida)Cu(B)Cu(ida) and (ida)Cu(H-1B)Cu(ida)-. Formation constants of the complexes at 25 ± 1° at a fixed ionic strength, = 0.1 mol dm-3 (NaNO3) in aqueous solution were evaluated and the complex formation equilibria were elucidated with the aid of speciation curves. Departure of the experimental values of the reproportionation constants (log Cu) of ternary Cu(ida)(H-1B)- complexes from the statistically expected values, despite their formation in appreciable amounts at equilibrium, were assigned to fac(f)-mer(m) equilibria of the ida2- ligand coordinated to CuII, as the N-heterocyclic donors, (H-1B)-, coordinate trans- to the N-(ida2-) atom in the binary Cu(ida) complex to form the ternary Cu(ida) (H-1B)- complexes.

  5. Synthesis, Crystal Structure, Spectroscopic Properties and Potential Biological Activities of Salicylate‒Neocuproine Ternary Copper(II Complexes

    Directory of Open Access Journals (Sweden)

    Lenka Kucková

    2015-01-01

    Full Text Available Mixed ligand copper(II complexes containing derivatives of salicylic acid and heterocyclic ligands with nitrogen donor atoms have been the subject of various studies and reviews. In this paper, synthesis and characterization of the ternary copper(II complexes of neocuproine (2,9-dimethyl-1,10-phenanthroline, Neo and salicylate ligands (Sal are reported. In addition, the crystal structures of ([Cu(H2O(5-Cl-Sal(Neo] (1, [Cu(μ-Sal(Neo]2 (2, Cu2(μ-5-Cl-Sal(5-Cl-HSal2(Neo2]·EtOH (3 were determined. In order to compare structural and biological properties of the prepared complexes, spectroscopic and biological studies were performed. Results of X-ray diffraction show that prepared complexes form three types of crystal structures in a given system: monomeric, dimeric and dinuclear complex. The preliminary study on the DNA cleavage activity has shown that the complexes under study behave as the chemical nucleases in the presence of added hydrogen peroxide with slight differences in the activity (1 > 2 > 3. The complexes 1 and 2 exhibited nuclease activity itself indicating the interaction of complexes with the DNA. It has been proposed that the enhanced destructive effect of the complexes 1 and 2 on the DNA is a result of two possible mechanisms of action: (i the conversion of closed circular DNA (form I to the nicked DNA (form II caused by the copper complex itself and (ii damage of DNA by Reactive Oxygen Species (ROS—products of the interaction of copper with hydrogen peroxide by means of Fenton reaction (hydroxyl radicals. Thus the biological activity of the prepared Cu(II complexes containing derivatives of salicylic acid and phenanthroline molecules is substantiated by two independent mechanisms. While derivatives of salicylic acids in the coordination sphere of copper complexes are responsible for radical-scavenging activity (predominantly towards superoxide radical anion, the presence of chelating ligand 2,9-dimethyl-1,10-phenanthroline

  6. Synthesis, Characterization, Crystal Structure and Stability of a Ternary Cu(Ⅱ) complex with 1,10-Phenanthroline and L-Valinate

    Institute of Scientific and Technical Information of China (English)

    ZHOU Xiao-hua; LE Xue-yi; LONG La-sheng; CHEN Shi

    2005-01-01

    @@ Introduction It is important to research the mixed-ligand copper complexes containing bioligands,such as amino acids, nucleic acids and proteins,in exploring the functional mechanism of microelement copper in organism because the reaction of any micronutrient with two or more bioligands in the concentrated bioligands background gives mixed-ligand ternary complexes, which are more stable[1]and related with storage of substance and transportation of metal ions in the life process.

  7. Complexes of hydroxamates. V: Equilibrium and kinetics of the formation of the binary and ternary complexes involved in the nickel(II)-histidinehydroxamic acid-pyridoxal system.

    Science.gov (United States)

    el-Ezaby, M S; Shuaib, N M; Marafie, H M; Hassan, M M

    1988-07-01

    Equilibrium-based computer models utilizing SUPERQUAD program were made to determine the formation constants of the binary complexes of Ni(II) with histidine-hydroxamic acid (HX) from pH-metric titration data at 25 degrees C and I = 0.15 M NaCl. The species were monomeric in the pH range 3.0-8.0. The mechanism of their complex formation was determined using the stopped flow technique under the same experimental conditions of the equilibrium study. It has been concluded that Ni2+ and NiOH- were the active species in the complex formation reactions. Moreover, the reaction of HX with pyridoxal (PL) was studied in the absence of metal-ions by polarographic and spectrophotometric techniques at pH greater than or equal to 5.0. No rates were observed by using the stopped-flow methods. The formation constants for the binary system (HX-PL) and the ternary system (Ni(II)-HX-PL) were also determined by the same program applied on data obtained from pH metric titration at 25 degrees C and I = 0.15 M NaCl. Ternary complex formation involving PL and the species of the Ni(II)-HX system was also investigated kinetically in the pH range of 6.5-10.5. Several rate steps have been observed which have been interpreted qualitatively in terms of sequence of processes involving the condensation of aldehydic form of PL with amino moiety of HX. A comparison with other pertinent systems is also discussed.

  8. Study on the Interaction of Ternary Complex Pd(Ⅱ)-2,2'-bipyridine-L-asparagic acid with DNA

    Institute of Scientific and Technical Information of China (English)

    高恩君; 赵淑敏; 张丹; 刘祁涛

    2005-01-01

    The ternary complex Pd(Ⅱ)-2,2'-bipyridine-L-asparagic acid was synthesized and characterized by elemental analysis, IR-spectra and molar conductance. The formula of the complex is Pd(bipy)(L-asp). The interaction of the complex with DNA has been studied by UV-spectra, fluorescence spectra, CD-spectra and gel electrophoresis. The results showed that the interaction of the complex with DNA performed mainly in intercalative mode and the extent of interaction was dependent on the concentration of the complex.

  9. Trialkylphosphine-stabilized copper(I) gallium(III) phenylchalcogenolate complexes: crystal structures and generation of ternary semiconductors by thermolysis.

    Science.gov (United States)

    Kluge, Oliver; Krautscheid, Harald

    2012-06-18

    A series of organometallic trialkylphosphine-stabilized copper gallium phenylchalcogenolate complexes [(R(3)P)(m)Cu(n)Me(2-x)Ga(EPh)(n+x+1)] (R = Me, Et, (i)Pr, (t)Bu; E = S, Se, Te; x = 0, 1) has been prepared and structurally characterized by X-ray diffraction. From their molecular structures three groups of compounds can be distinguished: ionic compounds, ring systems, and cage structures. All these complexes contain one gallium atom bound to one or two methyl groups, whereas the number of copper atoms, and therefore the nuclearity of the complexes, is variable and depends mainly on size and amount of phosphine ligand used in synthesis. The Ga-E bonds are relatively rigid, in contrast to flexible Cu-E bonds. The lengths of the latter are controlled by the coordination number and steric influences. The Ga-E bond lengths depend systematically on the number of methyl groups bound to the gallium atom, with somewhat shorter bonds in monomethyl compounds compared to dimethyl compounds. Quantum chemical computations reproduce this trend and show furthermore that the rotation of one phenyl group around the Ga-E bond is a low energy process with two distinct minima, corresponding to two different conformations found experimentally. Mixtures of different types of chalcogen atoms on molecular scale are possible, and then ligand exchange reactions in solution lead to mixed site occupation. In thermogravimetric studies the complexes were converted into the ternary semiconductors CuGaE(2). The thermolysis reaction is completed at temperatures between 250 and 400 °C, typically with lower temperatures for the heavier chalcogens. Because of significant release of Me(3)Ga during the thermolysis process, and especially in case of copper excess in the precursor complexes, binary copper chalcogenides are obtained as additional thermolysis products. Quaternary semiconductors can be obtained from mixed chalcogen precursors.

  10. A ternary complex comprising transportin1, Rab8 and the ciliary targeting signal directs proteins to ciliary membranes

    Science.gov (United States)

    Madugula, Viswanadh

    2016-01-01

    ABSTRACT The sensory functions of cilia are dependent on the enrichment of cilium-resident proteins. Although it is known that ciliary targeting signals (CTSs) specifically target ciliary proteins to cilia, it is still unclear how CTSs facilitate the entry and retention of cilium-resident proteins at the molecular level. We found that non-ciliary membrane reporters can passively diffuse into cilia through the lateral transport pathway, and the translocation of membrane reporters through the ciliary diffusion barrier is facilitated by importin binding motifs and domains. Screening known CTSs of ciliary membrane residents uncovered that fibrocystin, photoreceptor retinol dehydrogenase, rhodopsin and retinitis pigmentosa 2 interact with transportin1 (TNPO1) through previously identified CTSs. We further discovered that a new ternary complex, comprising TNPO1, Rab8 and a CTS, can assemble or disassemble under the guanine nucleotide exchange activity of Rab8. Our study suggests a new mechanism in which the TNPO1–Rab8–CTS complex mediates selective entry into and retention of cargos within cilia. PMID:27633000

  11. Ternary complex formation between the MADS-box proteins SQUAMOSA, DEFICIENS and GLOBOSA is involved in the control of floral architecture in Antirrhinum majus.

    Science.gov (United States)

    Egea-Cortines, M; Saedler, H; Sommer, H

    1999-10-01

    In Antirrhinum, floral meristems are established by meristem identity genes. Floral meristems give rise to floral organs in whorls, with their identity established by combinatorial activities of organ identity genes. Double mutants of the floral meristem identity gene SQUAMOSA and organ identity genes DEFICIENS or GLOBOSA produce flowers in which whorled patterning is partially lost. In yeast, SQUA, DEF and GLO proteins form ternary complexes via their C-termini, which in gel-shift assays show increased DNA binding to CArG motifs compared with DEF/GLO heterodimers or SQUA/SQUA homodimers. Formation of ternary complexes by plant MADS-box factors increases the complexity of their regulatory functions and might be the molecular basis for establishment of whorled phyllotaxis and combinatorial interactions of floral organ identity genes.

  12. Electrochemical Studies of Eight New Divalent Transition Metal Benzenesulphonate Ternary Complexes with 1,10-Phenanthroline

    Institute of Scientific and Technical Information of China (English)

    LU Yao; GUO Li-ping; MA Jian-fang; YANG Jin; WU Dongmei

    2004-01-01

    The electrochemical properties of eight new divalent transition metal benzenesulphonate complexes with 1,10-phenanthroline in different solvents and supporting electrolytes were investigated by means of cyclic voltammetry(CV). Based on the CV data the influences of various coordination modes on the electrochemical behavior of the complexes were discussed. The diffusion coefficient Dc and rate constant ks of those complexes in DMF systems were estimated according to CV and the results show that these processes were all quasi-reversible.

  13. Solvent effect on H-bond cooperativity factors in ternary complexes of methanol, octan-1-ol, 2,2,2-trifluoroethanol with some bases.

    Science.gov (United States)

    Solomonov, Boris N; Varfolomeev, Mikhail A; Abaidullina, Dilyara I

    2008-03-01

    Cooperative hydrogen bonds in ternary complexes (ROH)(2)...B (ROH-alcohols; B-bases) formed in pure bases (B) and solutions in n-hexane, carbon tetrachloride, benzene and 1,2-dichloroethane were studied by FTIR spectroscopy. Based on the observations, the authors were able to propose an original method of evaluating solvent effects on cooperativity factors in the complexes. Frequencies of cooperative hydrogen bonds OH...B (nu(b)) were determined for ternary complexes of pyridine with aliphatic alcohols (methanol, octan-1-ol) and for 2,2,2-trifluoroethanol with three different bases (acetonitrile, diethyl ether, tetrahydrofuran). The solvent shifts of nu(b) were found to correlate with an empirical thermochemical parameter of the solvent, S(VW). The cooperativity factors were determined for the complexes (ROH)(2)...B in all studied media. It has been found that the cooperativity factors are almost independent of the solvent. In addition, a method was proposed of estimating the frequencies and cooperativity factors for ternary complexes (ROH)(2)...B in the gas phase. It has been found that in gas phase the cooperativity factors are practically the same as in condensed media.

  14. Gd(Ⅲ)三元配合物EPR波谱研究%Studies on EPR Spectra of Gd(Ⅲ) Ternary Complexes

    Institute of Scientific and Technical Information of China (English)

    成义祥; 张征林; 徐元植

    2001-01-01

    Gd(Ⅲ) ternary complexes of the solid powder and THF solution have been investigated by EPR spectra. The EPR spectra of Gd(Ⅲ) ternary complexes have many differences due to the change of the coordinated synergic agents. Resonance peaks of the solid powder complexes dont show an obvious difference between room temperature and liquid nitrogen, but solution EPR spectra of Gd(Ⅲ) ternary complexes in the liquid nitrogen shows a superfine splitting, fine splitting and super-hyperfine splitting. Most Gd(Ⅲ) complexes show prominent “U” spectrum feature. It results from the EPR spectra that the strength of crystal field of Gd(Ⅲ) ternary complexes belongs to the intermediate CF category, the asymmetry parameter λ is changed with the variation of the synergic agents.%摘要对Gd(Ⅲ)的三元配合物室温和低温的固体粉末以及低温THF溶液EPR波谱的研究发现, Gd(Ⅲ)三元配合物固体粉末在室温和低温EPR波谱各共振吸收峰差异不大,但在低温THF溶液中EPR波谱出现超精细分裂,甚至存在超超精细分裂. Gd(Ⅲ)三元配合物随协同配体改变, EPR各共振吸收峰位置、强度和数目均存在较大变化,且不对称参数λ随协同配体不同而改变; 大多数Gd(Ⅲ)三元配合物表现“U”谱特征.

  15. Structural insights into complete metal ion coordination from ternary complexes of B family RB69 DNA polymerase.

    Science.gov (United States)

    Xia, Shuangluo; Wang, Mina; Blaha, Gregor; Konigsberg, William H; Wang, Jimin

    2011-10-25

    We have captured a preinsertion ternary complex of RB69 DNA polymerase (RB69pol) containing the 3' hydroxyl group at the terminus of an extendable primer (ptO3') and a nonhydrolyzable 2'-deoxyuridine 5'-α,β-substituted triphosphate, dUpXpp, where X is either NH or CH(2), opposite a complementary templating dA nucleotide residue. Here we report four structures of these complexes formed by three different RB69pol variants with catalytically inert Ca(2+) and four other structures with catalytically competent Mn(2+) or Mg(2+). These structures provide new insights into why the complete divalent metal-ion coordination complexes at the A and B sites are required for nucleotidyl transfer. They show that the metal ion in the A site brings ptO3' close to the α-phosphorus atom (Pα) of the incoming dNTP to enable phosphodiester bond formation through simultaneous coordination of both ptO3' and the nonbridging Sp oxygen of the dNTP's α-phosphate. The coordination bond length of metal ion A as well as its ionic radius determines how close ptO3' can approach Pα. These variables are expected to affect the rate of bond formation. The metal ion in the B site brings the pyrophosphate product close enough to Pα to enable pyrophosphorolysis and assist in the departure of the pyrophosphate. In these dUpXpp-containing complexes, ptO3' occupies the vertex of a distorted metal ion A coordination octahedron. When ptO3' is placed at the vertex of an undistorted, idealized metal ion A octahedron, it is within bond formation distance to Pα. This geometric relationship appears to be conserved among DNA polymerases of known structure.

  16. Nucleic acid interaction and antibacterial behaviours of a ternary palladium(II) complexes

    Science.gov (United States)

    Patel, Mohan N.; Dosi, Promise A.; Bhatt, Bhupesh S.

    2012-02-01

    The bidentate ligands and Pd(II) complexes have been synthesized and characterized using elemental analysis (C, H, N), 1H NMR, 13C NMR, electronic spectra, FT-IR and FAB mass spectroscopy. The binding of palladium complexes with calf thymus DNA (CT DNA) has been explored using absorption titration, DNA melting temperature and viscosity measurements. The cleavage reaction on pUC19 DNA has been monitored by agarose gel electrophoresis. The results suggest that complexes can bind to DNA by intercalative modes and exhibit nuclease activities in which supercoil form is converted to open circular form. The antibacterial activity of ligands and complexes has been performed against three Gram(-ve) and two Gram(+ve) microorganisms and the study indicates that all the complexes show better microbial inhibition activity than ligands and palladium salt.

  17. Fluorescence characteristic study of the ternary complex of fluoroquinolone antibiotics and cobalt (II) with ATP

    Science.gov (United States)

    Wu, Shuqing; Zhang, Wujuan; Chen, Xingguo; Hu, Zhide; Hooper, Martin; Hooper, Beveley; Zhao, Zhengfeng

    2001-05-01

    The results from the measurement of the fluorescence spectra of fluoroquinolone antibiotics including ofloxacin (OF), norfloxacin (NOR) and ciprofloxacin (CIP) complexed with cobalt (II) and ATP give information concerning the antibiotics-nucleotide interactions. From the fluorescence spectral data, it appears that the fluoroquinolone antibiotic cannot directly complex with ATP but indirectly complex with cobalt (II), which is playing an intermediary role. The interaction of fluoroquinolone antibiotic with the nucleotide occurs mainly through the phosphate group. The conclusion offers a more complete mechanism, which is important for understanding the interaction of these drugs with DNA.

  18. Ternary inclusion complex formation and stabilization of limaprost, a prostaglandin E1 derivative, in the presence of α- and β-cyclodextrins in the solid state.

    Science.gov (United States)

    Inoue, Yasuo; Iohara, Daisuke; Sekiya, Noboru; Yamamoto, Masanobu; Ishida, Hiroyuki; Sakiyama, Yoko; Hirayama, Fumitoshi; Arima, Hidetoshi; Uekama, Kaneto

    2016-07-25

    Limaprost/α-cyclodextrin (CD)/β-CD ternary inclusion complex was prepared by freeze-drying a solution containing all three components. Under humid conditions, limaprost was more stable in the ternary α-/β-CD inclusion complex than in the binary α- or β-CD complex. Specifically, during storage at 30°C/75% relative humidity (R.H.) for 4 weeks, about 19% of limaprost degraded into 17S,20-dimethyl-trans-Δ(2)-prostaglandin A1 (referred as 11-deoxy-Δ(10)) in the β-CD complex, 8.1% degraded in the α-CD complex, and only 2.2% degraded in the α-/β-CD complex. The mechanism of limaprost stabilization in the presence of both CDs was investigated by Raman and solid-state NMR spectroscopy and powder X-ray diffractometry. The fast degradation of limaprost to 11-deoxy-Δ(10) in the β-CD complex was due to the rapid crystallization of β-CD from the complex, liberating the free amorphous drug, which is susceptible to degradation. The dissociation and crystallization of β-CD from the inclusion complex were suppressed by freeze-drying limaprost in the presence of both α- and β-CDs. In addition, the interaction between limaprost and the two CDs was reinforced by inclusion of different moieties of limaprost: α-CD predominantly included the alkyl ω-chain, whereas β-CD included the five-membered ring. Thus, a stable ternary inclusion complex was formed that included limaprost, maintaining the amorphous state of the complex and dramatically stabilizing the drug under humid conditions.

  19. Synthesis and luminescence properties of rare earth ternary complexes consisting of Tb(Ⅲ),β-diketones and 1,10-phenanthroline (phen)

    Institute of Scientific and Technical Information of China (English)

    2008-01-01

    In order to study the luminescent properties of ternary rare earth complexes with fl-diketone ligand,three new β-diketone ligands,1-phenyl-3-(p-phenylethynylphenyl)-1,3-propanedione(HPPP), 1-(2-thienyl)-3-(p-phenylethynylphenyl)-l,3-propanedione (HTPP) and 1-(2-furyl)-3-(p-phenylethynylphenyl)-1,3-propanedione (HFPP),were synthesized by Sonogashira coupling reaction and Claisen condensation.Three new ternary rare earth complexes,TbL3phen (L = PPP,TPP,or FPP),were synthesized by the reaction of rare earth chloride TbCl3,1,10-phenanthroline (phen) with HPPP,HTPP,or HFPP respectively,in alcohol solution.The compositions were characterized by means of elernental analysis,chemical analysis,and IR spectra.Luminescent properties of the three new complexes have been studied.The results show that the ternary Tb(Ⅲ) complexes only emit the weak fluorescence of the Tb(Ⅲ) ion,which reveals the triplet state energy of the ligands does not match well with the excited state vibrating energy of Tb3+ ion.

  20. Hydrogen-Bonding Capability of a Templating Difluorotoluene Nucleotide Residue in an RB69 DNA Polymerase Ternary Complex

    Energy Technology Data Exchange (ETDEWEB)

    Xia, Shuangluo; Konigsberg, William H.; Wang, Jimin (Yale)

    2011-08-29

    Results obtained using 2,4-difluorotoluene nucleobase (dF) as a nonpolar thymine isostere by Kool and colleagues challenged the Watson-Crick dogma that hydrogen bonds between complementary bases are an absolute requirement for accurate DNA replication. Here, we report crystal structure of an RB69 DNA polymerase L561A/S565G/Y567A triple mutant ternary complex with a templating dF opposite dTTP at 1.8 {angstrom}-resolution. In this structure, direct hydrogen bonds were observed between: (i) dF and the incoming dTTP, (ii) dF and residue G568 of the polymerase, and (iii) dF and ordered water molecules surrounding the nascent base pair. Therefore, this structure provides evidence that a templating dF can form novel hydrogen bonds with the incoming dTTP and with the enzyme that differ from those formed with a templating dT.

  1. Binary and ternary complexes of some inner transition metal ions with amino acids and acetyl acetone

    Science.gov (United States)

    Abu-Eittah, R. H.; Abdou, M. M.; Salem, M. B.

    1998-05-01

    The stability constants of the 1:1 and 1:2 (whenever possible) complexes formed between La3+, Ce3+, Th4+ and the amino acid anions L-alaninate, L-phenylalaninate and L-histidinate were determined by potentiometric titration in aqueous solution (25± 1 ^circC, I = 0.1 M KCl) and compared together with the constants previously determined. The various formation degree of the resulting M(L) and M(L)2 were determined. In order to relate the formation degree of M(L) and M(L)2 with the basicity of the amino acid anion (L^-), the acidity constants of the protonated amino acids, H2L^+, were also measured. The main results of this work prove that Th4+ ion forms the strongest complex with the studied amino acids. It is the only ion which forms a 1:2 complex. The heterocyclic ring of histidine plays a significant role in complexing with the studied metal ions as is clearly seen from the distribution of the degree of formation of the different complexes. The stability constants of the 1:1:1, 1:2:1 and 1:1:2 complexes formed between La3+, Ce3+, Th4+ and the anions L-alaninate, L-phenylalaninate and L-histidinate together with the acetyl acetonate ion were also determined following the same experimental set up used in the study of the simple complexes. The mixed-ligand complexes turned out to be very much stronger than the simple ligand complexes. Formation of a mixed ligand complex can be considered as a type of senergism. Les constantes de stabilité des complexes 1:1 et 2:2 (lorsque cela est possible) formés entre La3+, Ce3+, Th4+ et les anions aminoacides L-alaninate, L-phénylalaninate et L-histidinate ont été déterminées par dosage potentiométrique en solution aqueuse (25± 1 ^circC, I = 0,1 M KCl), et comparées à celles de la littérature. Les différents degrés de formation de M(L) et M(L)2 ont été quantifiés. Pour mettre en évidence la relation entre le degré de formation de M(L) et M(L)2 et la basicité des anions aminoacides (L^-), les constantes d

  2. A ternary tetracoordinated Pd II complex with metformin and dipicolinate: Synthesis, characterization and crystal structure

    Science.gov (United States)

    Moghimi, A.; Khavassi, H. R.; Dashtestani, F.; Kordestani, D.; Ekram Jafari, A.; Maddah, B.; Moosavi, S. M.

    2011-06-01

    A proton transfer compound L, (MetH) 2(dipic), (dipicH 2 = 2,6-pyridinedicarboxylic acid and Met = Metformin (N,N-dimethylebiguanidine), was synthesized and characterized by IR, 1H and 13C NMR spectroscopy. The reaction of L with PdCl 2 in water results in the formation of novel tetracoordinated Pd II complex [Pd(dipic)(Met)]·2H 2O indicating the participation of both dipic 2- and Met as chelating ligands. This complex was characterized by single crystal X-ray analysis. The crystal system is monoclinic with space group P2 1/c. The unit cell dimensions for Pd II complex 1 is a = 8.8619(14) Å, b = 9.5072(9) Å, c = 19.153(3) Å.

  3. Ternary complexes of albumin-Mn(II)-bilirubin and Electron Spin Resonance studies of gallstones

    CERN Document Server

    Chikvaidze, E N; Kirikashvili, I N; Mamniashvili, G I

    2009-01-01

    The stability of albumin-bilirubin complex was investigated depending on pH of solution. It was shown that the stability of complex increases in presence of Mn(II) ions. It was also investigated the paramagnetic composition of gallstones by the electron spin resonance (ESR) method. It turned out that all investigated gallstones contain a free bilirubin radical-the stable product of its radical oxidation. Accordingly the paramagnetic composition gallstones could be divided on three main types: cholesterol, brown pigment and black pigment stones. ESR spectra of cholesterol stones is singlet with g=2.003 and splitting between components 1.0 mT. At the same time the brown gallstones, besides aforementioned signal contain the ESR spectrum which is characteristics for Mn(II) ion complexes with inorganic compounds and, finally, in the black pigment stones it was found out Fe(III) and Cu(II) complexes with organic compounds and a singlet of bilirubin free radical. It is supposed that crystallization centers of gallst...

  4. Studying multisite binary and ternary protein interactions by global analysis of isothermal titration calorimetry data in SEDPHAT: application to adaptor protein complexes in cell signaling.

    Science.gov (United States)

    Houtman, Jon C D; Brown, Patrick H; Bowden, Brent; Yamaguchi, Hiroshi; Appella, Ettore; Samelson, Lawrence E; Schuck, Peter

    2007-01-01

    Multisite interactions and the formation of ternary or higher-order protein complexes are ubiquitous features of protein interactions. Cooperativity between different ligands is a hallmark for information transfer, and is frequently critical for the biological function. We describe a new computational platform for the global analysis of isothermal titration calorimetry (ITC) data for the study of binary and ternary multisite interactions, implemented as part of the public domain multimethod analysis software SEDPHAT. The global analysis of titrations performed in different orientations was explored, and the potential for unraveling cooperativity parameters in multisite interactions was assessed in theory and experiment. To demonstrate the practical potential and limitations of global analyses of ITC titrations for the study of cooperative multiprotein interactions, we have examined the interactions of three proteins that are critical for signal transduction after T-cell activation, LAT, Grb2, and Sos1. We have shown previously that multivalent interactions between these three molecules promote the assembly of large multiprotein complexes important for T-cell receptor activation. By global analysis of the heats of binding observed in sets of ITC injections in different orientations, which allowed us to follow the formation of binary and ternary complexes, we observed negative and positive cooperativity that may be important to control the pathway of assembly and disassembly of adaptor protein particles.

  5. Insight to ternary complexes of co-adsorption of norfloxacin and Cu(II) onto montmorillonite at different pH using EXAFS.

    Science.gov (United States)

    Pei, Zhi-Guo; Shan, Xiao-Quan; Zhang, Shu-Zhen; Kong, Jing-Jing; Wen, Bei; Zhang, Jing; Zheng, Li-Rong; Xie, Ya-Ning; Janssens, Koen

    2011-02-15

    Co-adsorption of norfloxacin (Nor) and Cu(II) on montmorillonite at pH 4.5, 7.0 and 9.0 was studied by integrated batch adsorption experiments and extended X-ray absorption fine structure (EXAFS) spectroscopy. Under such pH conditions the dominant species of Nor are cation (Nor(+)), zwitterion (Nor(±)), and anion (Nor(-)), respectively. Results indicated that Nor sorption decreased with an increase of solution pH. The presence of Cu(II) slightly suppressed the Nor(+) sorption at pH 4.5, while increased Nor(±) and Nor(-)sorption on montmorillonite at pH 7.0 and 9.0, respectively. In contrast, Nor increased Cu(II) adsorption at pH 4.5, but had little effect on the adsorption of Cu(II) on montmorillonite at pH 7.0 and 9.0. Spectroscopic results showed that, at pH 4.5, Nor(+) was sorbed on montmorillonite by the formation of outer-sphere montmorillonite-Nor-Cu(II) ternary surface complex. At pH 7.0, montmorillonite-Nor-Cu(II) and montmorillonite-Cu(II)-Nor ternary surface complexes co-exist. At pH 9.0, montmorillonite-Cu(II)-Nor ternary surface complex was likely formed, which was different to Cu(II)(Nor)(2) precipitate of the solution. Copyright © 2010 Elsevier B.V. All rights reserved.

  6. Tumor Acidity-Induced Sheddable Polyethylenimine-Poly(trimethylene carbonate)/DNA/Polyethylene Glycol-2,3-Dimethylmaleicanhydride Ternary Complex for Efficient and Safe Gene Delivery.

    Science.gov (United States)

    Zhao, Caiyan; Shao, Leihou; Lu, Jianqing; Deng, Xiongwei; Wu, Yan

    2016-03-01

    Amphiphilic PEI derivatives/DNA complexes are widely used for DNA delivery, but they are unstable in vivo and have cytotoxicity due to the excess cationic charge. PEGylation of cationic complexes can improve sterical stability and biocompatibility. However, PEGylation significantly inhibits cellular uptake and endosomal escape. In this work, sheddable ternary complexes were developed by coating a tumor acidity-sensitive β-carboxylic amide functionalized PEG layer on the binary complexes of amphiphilic cationic polyethylenimine-poly(trimethylene carbonate) nanoparticles/DNA (PEI-PTMC/DNA). Such sheddable ternary complexes markedly reduced their nonspecific interactions with serum protein in the bloodstream and obtained minimal cytotoxicity due to the protection of the PEG shell. At the tumor site, the PEG layer was deshielded by responding to the tumor acidic microenvironment and the positively charged complexes re-exposed that had higher affinity with negatively charged cell membranes. Meanwhile the positively charged complexes facilitated endosomal escape. Accordingly, this delivery system improved the biocompatibility of gene-loaded complexes and enhanced the gene transfection efficiency. Such PEGylated complexes with the ability to deshield the PEG layer at the target tissues hold great promise for efficient and safe gene delivery in vivo.

  7. Synthesis, X-ray structure and luminescent properties of Sm3+ ternary complex with novel heterocyclic β-diketone and 1,10-phenanthroline (Phen)

    Institute of Scientific and Technical Information of China (English)

    Ilya V. Taydakov; Boris E. Zaitsev; Sergey S. Krasnoselskiy; Zoya A. Starikova

    2011-01-01

    A new neutral ternary samarium complex Sm(Phen)HL3 in which Phen is 1,10-phenanthroline and HL is (1,3-bis(1,3-dimethyl1H-pyrazol-4-yl)-1,3-propanedione) was synthesized.Molecular structure of this complex was determined by X-ray diffraction.Under UV-light this complex is demonstrated bright red luminescence (λmax=647 nm),which was corresponding to the electric dipole 4G5/2→,6H9/2 transition in Sm3+ ion.UV-absorption,excitation and emission spectra of the title compound were investigated.

  8. Helical ternary complexes of alkaline earth picrates with open-chain crown ether

    Institute of Scientific and Technical Information of China (English)

    刘伟生; 温永红; 刘雪原; 谭民裕

    2003-01-01

    Four solid complexes of alkaline earth picrates with N,N,N′,N′-tetraphenyl-3,6,9-tri- oxaundecanediamide (TTD), M (Pic)2TTD (1, M = Mg; 2, M = Ca; 3, M = Sr; 4, M = Ba), have been prepared and characterized by elemental analysis, conductivity measurement, IR spectra, 1H NMR spectra and TG-DTA techniques. Crystal structure of complex 3 shows that the Sr(Ⅱ) ion is 9-coordinated by five oxygen atoms from TTD and four oxygen atoms from two bidentate picrates, and the coordination polyhedron is distorted tricapped trigonal prism. TTD as a pentadentate ligand forms a right-handed helical coordination structure. The chelating helical chain has a relative fixed radius and then shows a high coordination selectivity to metal ion. The high selectivity of TTD to alkaline earth ions is explained elementarily from the special coordination structures.

  9. Ternary complexes of cobalt cysteinylglycine with histidylserine and histidylphenylalanine-stabilities and DNA cleavage properties

    Indian Academy of Sciences (India)

    Pulimamidi R Reddy; Pallerla Manjula

    2007-11-01

    Interaction of cobalt cysteinylglycine with histidylserine and histidylphenylalanine was investigated in a 1 : 1 : 1 ratio at 35°C and 0.10 mol dm-3 ionic strength. Their stabilities and geometries were determined. Their DNA binding and cleavage properties were investigated. The intrinsic binding constants () for DNA bound 1 and 2 (3.03 × 103 M-1 for 1 and 3.87 × 103 M-1 for 2) were determined. Even though the negative charge on the complexes reduced their affinity for DNA, there was an enhancement of binding through specificity. The degradation of plasmid DNA was achieved by cobalt dipeptide complexes [CoII(CysGly)(HisSer)] (1) and [CoII(CysGly)(HisPhe)] (2). Cleavage experiments revealed that 1 and 2 cleave supercoiled DNA (form I) to nicked circular (form II) through hydrolytic pathway at physiological H. The DNA hydrolytic cleavage rate constants for complexes 1 and 2 were determined to be 0.62 h-1, for 1 and 0.38 h-1 for 2 respectively.

  10. The structure of the ternary Eg5–ADP–ispinesib complex

    Energy Technology Data Exchange (ETDEWEB)

    Talapatra, S. K., E-mail: s.talapatra@beatson.gla.ac.uk; Schüttelkopf, A. W., E-mail: s.talapatra@beatson.gla.ac.uk; Kozielski, F. [The Beatson Institute for Cancer Research, Garscube Estate, Switchback Road, Bearsden, Glasgow G61 1BD, Scotland (United Kingdom)

    2012-10-01

    The complex between the motor protein Eg5 and the phase II clinical candidate ispinesib provides insights into the mechanism of action of this important class of inhibitors. The human kinesin Eg5 is responsible for bipolar spindle formation during early mitosis. Inhibition of Eg5 triggers the formation of monoastral spindles, leading to mitotic arrest that eventually causes apoptosis. There is increasing evidence that Eg5 constitutes a potential drug target for the development of cancer chemotherapeutics. The most advanced Eg5-targeting agent is ispinesib, which exhibits potent antitumour activity and is currently in multiple phase II clinical trials. In this study, the crystal structure of the Eg5 motor domain in complex with ispinesib, supported by kinetic and thermodynamic binding data, is reported. Ispinesib occupies the same induced-fit pocket in Eg5 as other allosteric inhibitors, making extensive hydrophobic interactions with the protein. The data for the Eg5–ADP–ispinesib complex suffered from pseudo-merohedral twinning and revealed translational noncrystallographic symmetry, leading to challenges in data processing, space-group assignment and structure solution as well as in refinement. These complications may explain the lack of available structural information for this important agent and its analogues. The present structure represents the best interpretation of these data based on extensive data-reduction, structure-solution and refinement trials.

  11. Zirconia-based luminescent organic-inorganic hybrid materials with ternary europium (III) complexes bonded

    Science.gov (United States)

    Yang, Jing; Li, Zhiqiang; Xu, Yang; Wang, Yige

    2016-05-01

    In this work, a novel red-emitting organic-inorganic hybrid material with europium (III) lanthanide β-diketonate complexes linked to a zirconia was reported, which was realized by adduct formation with zirconia-tethered terpyridine moieties. Luminescence enhancement of the hybrid material has been observed compared with pure Eu(tta)3·2H2O. Transparent and strongly luminescent thin films based on PMMA were also prepared at room temperature, which are highly luminescent under UV-light irradiation and possess a promising prospect in the area of optics.

  12. The acid-labile subunit of the ternary insulin-like growth factor complex in cirrhosis

    DEFF Research Database (Denmark)

    Møller, S; Juul, A; Becker, U;

    2000-01-01

    In the circulation, insulin-like growth factor-I (IGF-I) is bound in a trimeric complex of 150 kDa with IGF binding protein-3 (IGFBP-3) and the acid-labile subunit (ALS). Whereas circulating IGF-I and IGFBP-3 are reported to be low in patients with chronic liver failure, the level of ALS has...... not been described in relation to hepatic dysfunction. The aim of the present study was therefore to measure circulating and hepatic venous concentrations of ALS in relation to hepatic function and the IGF axis....

  13. Photo- and Electro-luminescence of the New Ternary Europium(Ⅲ) Complex

    Institute of Scientific and Technical Information of China (English)

    Chen Xia DU; Zhi Qiang WANG; Qi XIN; Yang Jie WU; Wen Lian LI

    2005-01-01

    A new luminescent europium complex [Eu(DBM)3dpq] (DBM = 1, 3-diphenyl-1, 3-propanedionate and dpq=dipyrido[2,3-f][2',3'-h]quinoxaline) has been synthesized and shows intense red emission under UV excitation. With the device structure ITO/TPD/Eu(DBM)3dpq:TPD (1:2)/Gd(DBM)3bath/Mg:Ag, sharp-band red emissions with low turn-on voltage of 3V and high brightness of 304cd m-2 were achieved.

  14. Estimation of Stability Constants of Copper(Ⅱ) Complexes with a-Amino Acids Using Connectivity Index 3xV, Common Model for the Binary and Ternary Complexes%Estimation of Stability Constants of Copper(Ⅱ) Complexes with a-Amino Acids Using Connectivity Index 3xV, Common Model for the Binary and Ternary Complexes

    Institute of Scientific and Technical Information of China (English)

    Milicevic, Ante; Raos, Nenad

    2011-01-01

    Models for estimation of the first (K1), second (K2), and overall stability constant (β2) of copper(II) chelates with naturally occurring amino acids, based on the valence connectivity index of the 3rd order (3Xr), were improved by introduction of a square term and a new graph representation for mono-complexes (MLCor). The models gave SE = 0.07, 0.05--0.07 and 0.05--0.08 for lg Ki, lg K2 and lg ,62 constants, respectively; models that encompass both bi- nary and ternary bis-complexes included indicator variable. We also validated our models on the test set which in- cluded two mono-, two binary and two ternary Cu(II) chelates with a-aminobutanoic acid and a-aminopentanoic acid, not included into the calibration. The absolute differences between experimental and predicted stability con- stants were in the range of 0.01--0.16.

  15. Studies of ternary surface complexes at liquid-solid interfaces in seawater. 3: Comparative studies of the E(%)-pH curves and the diffuse reflectance IR spectra of the {alpha}-FeOOH-Cu(II)-tryptophan system

    Energy Technology Data Exchange (ETDEWEB)

    Zhang Zhengbin; Wang Wei; Liu Liansheng; Fu Youjun; Wu Zhijian [Ocean Univ. of Qingdao (China). Inst. of Marine Chemistry

    1997-06-01

    The E(%)-pH curves of the ternary surface complexes at liquid-solid interfaces in the simulated seawater system of {alpha}-FeOOH-Cu(II)-tryptophan were determined. The diffuse reflectance IR spectra of the species at the solid surfaces in the above ternary equilibration system were examined. The above two results were comparatively studied. It is shown that the coadsorption of Cu(II) and tryptophan on {alpha}0FeOOH surface results in the formation of the ternary surface complex. Cu(II) can promote the exchange adsorption of tryptophan on {alpha}-FeOOH surface. The diffuse reflectance IR spectra can give one some evidence for the structure of the ternary surface complex, and these results are in accordance with the results of the E(%)-pH curves.

  16. Thermodynamics of Binary and Ternary Solutions of Multivalent Electrolytes with Formation of 1: 1 and 1: 2 Complexes, within the Mean Spherical Approximation

    Energy Technology Data Exchange (ETDEWEB)

    Torres-Arenas, J.; Simonin, J. P.; Bernard, O. [Univ Paris 06, PECSA, CNRS, UMR 7195, F-75252 Paris (France); Torres-Arenas, J. [Univ Guanajuato, Div Ciencias and Ingn, Guanajuato 37150 (Mexico); Ruas, A.; Moisy, Ph. [CEA Marcoule, DEN DRCP, F-30207 Bagnols Sur Ceze (France)

    2010-07-01

    The mean activity ({gamma}{+-}) and osmotic ({Phi}) coefficients for binary and ternary aqueous solutions of trivalent electrolytes (mainly made up of lanthanide salts) are described in the framework of the primitive model of ionic solutions, using the binding mean spherical approximation (BiMSA). This model, based on the Wertheim formalism, accounts for (chemical or electrostatic) association of ions. In this work, the multivalent cation and the anion are allowed to form 1: 1 (pairs) and 1: 2 (trimers) complexes. Expressions for {gamma}{+-}) and {Phi} are given which satisfy the Gibbs-Duhem relation. The model involves concentration-dependent cation size and effective relative permittivity, variations that can be interpreted in terms of solvent effects. The theory is applied to aqueous solutions of binary and ternary mixtures at 25 C with common anion. (authors)

  17. Selective determination of total vanadium in water samples by cloud point extraction of its ternary complex

    Energy Technology Data Exchange (ETDEWEB)

    Filik, Hayati [Istanbul University, Faculty of Engineering, Department of Chemistry, Avcilar, 34320 Istanbul (Turkey)], E-mail: filik@istanbul.edu.tr; Yanaz, Zeynep; Apak, Resat [Istanbul University, Faculty of Engineering, Department of Chemistry, Avcilar, 34320 Istanbul (Turkey)

    2008-07-14

    A highly sensitive micelle-mediated extraction methodology for the preconcentration of trace levels of vanadium as a prior step to its determination by flame atomic absorption spectrometry (FAAS) has been developed. Vanadium was complexed with 1-(2-pyridylazo)-2-naphthol (PAN) and hydrogen peroxide in acidic medium (0.2 mol L{sup -1} phosphoric acid) using Triton X-100 as surfactant and quantitatively extracted into a small volume of the surfactant-rich phase after centrifugation. The color reaction of vanadium ions with hydrogen peroxide and PAN in phosphoric acid medium is highly selective. The chemical variables affecting cloud point extraction (CPE) were evaluated and optimized. The R.S.D. for 5 replicate determinations at the 20 {mu}g L{sup -1} V level was 3.6%. The calibration graph using the preconcentration system for vanadium was linear with a correlation coefficient of 0.99 at levels near the detection limits up to at least 0.6 {mu}g L{sup -1}. The method has good sensitivity and selectivity and was applied to the determination of trace amounts of vanadium in water samples with satisfactory result. The proposed method is a rare application of CPE-atomic spectrometry to vanadium assay, and is superior to most other similar methods, because its useful pH range is in the moderately acidic range achieved with phosphoric acid. At this pH, many potential interferents are not chelated with PAN, and iron(III) as the major interferent is bound in a stable phosphate complex.

  18. Potentiometric and UV Spectral Studies of Binary and Ternary Complexes of Some Metal Ions with N-Acetylcysteine and Amino Acids

    Directory of Open Access Journals (Sweden)

    Shaesta Quyoom

    2009-01-01

    Full Text Available The formation constants of the binary 1:1 and 1:2 complexes of Cu(II, Zn(II, Cd(II, Hg(II, and Pb(II with N-acetylcysteine (NAC and 1:1:1 ternary complexes of the said metal ions with NAC as a primary ligand and some biologically important amino acids as secondary ligands have been determined potentiometrically in aqueous medium. Acid dissociation constants of the ligands used and the formation constants of the binary and the ternary complexes were determined at 25 °C and in ionic strength I=0.1 mol dm-3 (KNO3.The formation constants of the 1:1 complexes were found to be higher than 1:2 complexes and the metal ions follow the order Hg(II >Cu(II >Cd(II >Zn(II. In addition UV-spectral studies of the NAC-Metal (II complexes have also been conducted at appropriate pH values to give further information about the structural nature of NAC- Metal (II complexes in aqueous medium.

  19. Resveratrol upregulates Egr-1 expression and activity involving extracellular signal-regulated protein kinase and ternary complex factors

    Energy Technology Data Exchange (ETDEWEB)

    Rössler, Oliver G.; Glatzel, Daniel; Thiel, Gerald, E-mail: gerald.thiel@uks.eu

    2015-03-01

    Many intracellular functions have been attributed to resveratrol, a polyphenolic phytoalexin found in grapes and in other plants. Here, we show that resveratrol induces the expression of the transcription factor Egr-1 in human embryonic kidney cells. Using a chromosomally embedded Egr-1-responsive reporter gene, we show that the Egr-1 activity was significantly elevated in resveratrol-treated cells, indicating that the newly synthesized Egr-1 protein was biologically active. Stimulus-transcription coupling leading to the resveratrol-induced upregulation of Egr-1 expression and activity requires the protein kinases Raf and extracellular signal-regulated protein kinase ERK, while MAP kinase phosphatase-1 functions as a nuclear shut-off device that interrupts the signaling cascade connecting resveratrol stimulation with enhanced Egr-1 expression. On the transcriptional level, Elk-1, a key transcriptional regulator of serum response element-driven gene transcription, connects the intracellular signaling cascade elicited by resveratrol with transcription of the Egr-1 gene. These data were corroborated by the observation that stimulation of the cells with resveratrol increased the transcriptional activation potential of Elk-1. The SRE as well as the GC-rich DNA binding site of Egr-1 function as resveratrol-responsive elements. Thus, resveratrol regulates gene transcription via activation of the stimulus-regulated protein kinases Raf and ERK and the stimulus-responsive transcription factors TCF and Egr-1. - Highlights: • The plant polyphenol resveratrol upregulates Egr-1 expression and activity. • The stimulation of Egr-1 requires the protein kinases ERK and Raf. • Resveratrol treatment upregulates the transcriptional activation potential of Elk-1. • Resveratrol-induced stimulation of Egr-1 requires ternary complex factors. • Two distinct resveratrol-responsive elements were identified.

  20. Cyclodextrins and ternary complexes: technology to improve solubility of poorly soluble drugs

    Directory of Open Access Journals (Sweden)

    Janisse Crestani de Miranda

    2011-12-01

    Full Text Available Cyclodextrins (CDs are cyclic oligosaccharides composed of D-glucopyranoside units linked by glycosidic bonds. Their main property is the ability to modify the physicochemical and biological characteristics of low-soluble drugs through the formation of drug:CD inclusion complexes. Inclusion complexation requires that host molecules fit completely or partially within the CD cavity. This adjustment is directly related to the physicochemical properties of the guest and host molecules, easy accommodation of guest molecules within the CD cavity, stoichiometry, therapeutic dose, and toxicity. However, dosage forms may achieve a high volume, depending on the amount of CD required. Thus, it is necessary to increase solubilization efficiency in order to use smaller amounts of CD. This can be achieved by adding small amounts of water-soluble polymers to the system. This review addresses aspects related to drug complexation with CDs using water-soluble polymers to optimize the amount of CD used in the formulation in order to increase drug solubility and reduce dosage form volume.Ciclodextrinas (CDs são oligossacarídeos cíclicos, compostos por unidades D-glicopiranosídicas ligadas entre si por meio de ligações glicosídicas e sua principal propriedade está na capacidade de alterar as características físico-químicas e biológicas de fármacos com baixa solubilidade por meio da formação de complexos de inclusão fármaco:CD. Para a formação dos complexos de inclusão a molécula hospedeira necessita ajustar-se total ou parcialmente no interior da cavidade da CD, onde este ajuste está diretamente ligado a propriedades físico-químicas da molécula hóspede e hospedeira, facilidade de alojamento da molécula hóspede no interior da cavidade da CD, estequiometria, dose terapêutica e toxicidade. No entanto, as formas farmacêuticas podem atingir um elevado volume, em função da quantidade de CD requerida, sendo necessário aumentar sua efici

  1. Analysis of altered complexity of gait dynamics with aging and Parkinson’s disease using ternary Lempel–Ziv complexity

    Directory of Open Access Journals (Sweden)

    Chandrakar Kamath

    2016-12-01

    Full Text Available Fluctuations in stride interval series show complex dynamical behavior in healthy young adults. Hypothesizing that these stride interval complexity changes would be altered by changes in neurological function associated with aging and certain disease states, we aimed to develop a tool to facilitate clinical judgments to assess the complex dynamical behavior in the stride series in discerning young, elderly, and Parkinson’s disease (PD classes. This novel approach, which employs a new variant of coarse-graining in conjunction with Lempel–Ziv complexity measure, yields useful, reliable, and predictive results. We also show the presence of nonlinear deterministic structures in the stride time series and appropriateness of the application of our nonlinear approach through surrogate data analysis. The findings show that the fluctuations are more complex/random in elderly and PD classes than those in young class. These findings may add to the growing body of literature supporting the clinical utility of this new approach to stride time series.

  2. SAG101 forms a ternary complex with EDS1 and PAD4 and is required for resistance signaling against turnip crinkle virus.

    Science.gov (United States)

    Zhu, Shifeng; Jeong, Rae-Dong; Venugopal, Srivathsa C; Lapchyk, Ludmila; Navarre, DuRoy; Kachroo, Aardra; Kachroo, Pradeep

    2011-11-01

    EDS1, PAD4, and SAG101 are common regulators of plant immunity against many pathogens. EDS1 interacts with both PAD4 and SAG101 but direct interaction between PAD4 and SAG101 has not been detected, leading to the suggestion that the EDS1-PAD4 and EDS1-SAG101 complexes are distinct. We show that EDS1, PAD4, and SAG101 are present in a single complex in planta. While this complex is preferentially nuclear localized, it can be redirected to the cytoplasm in the presence of an extranuclear form of EDS1. PAD4 and SAG101 can in turn, regulate the subcellular localization of EDS1. We also show that the Arabidopsis genome encodes two functionally redundant isoforms of EDS1, either of which can form ternary complexes with PAD4 and SAG101. Simultaneous mutations in both EDS1 isoforms are essential to abrogate resistance (R) protein-mediated defense against turnip crinkle virus (TCV) as well as avrRps4 expressing Pseudomonas syringae. Interestingly, unlike its function as a PAD4 substitute in bacterial resistance, SAG101 is required for R-mediated resistance to TCV, thus implicating a role for the ternary complex in this defense response. However, only EDS1 is required for HRT-mediated HR to TCV, while only PAD4 is required for SA-dependent induction of HRT. Together, these results suggest that EDS1, PAD4 and SAG101 also perform independent functions in HRT-mediated resistance.

  3. An unexpected phosphate binding site in Glyceraldehyde 3-Phosphate Dehydrogenase: Crystal structures of apo, holo and ternary complex of Cryptosporidium parvum enzyme

    Directory of Open Access Journals (Sweden)

    Chattopadhyay Debasish

    2009-02-01

    Full Text Available Abstract Background The structure, function and reaction mechanism of glyceraldehyde 3-phosphate dehydrogenase (GAPDH have been extensively studied. Based on these studies, three anion binding sites have been identified, one 'Ps' site (for binding the C-3 phosphate of the substrate and two sites, 'Pi' and 'new Pi', for inorganic phosphate. According to the original flip-flop model, the substrate phosphate group switches from the 'Pi' to the 'Ps' site during the multistep reaction. In light of the discovery of the 'new Pi' site, a modified flip-flop mechanism, in which the C-3 phosphate of the substrate binds to the 'new Pi' site and flips to the 'Ps' site before the hydride transfer, was proposed. An alternative model based on a number of structures of B. stearothermophilus GAPDH ternary complexes (non-covalent and thioacyl intermediate proposes that in the ternary Michaelis complex the C-3 phosphate binds to the 'Ps' site and flips from the 'Ps' to the 'new Pi' site during or after the redox step. Results We determined the crystal structure of Cryptosporidium parvum GAPDH in the apo and holo (enzyme + NAD state and the structure of the ternary enzyme-cofactor-substrate complex using an active site mutant enzyme. The C. parvum GAPDH complex was prepared by pre-incubating the enzyme with substrate and cofactor, thereby allowing free movement of the protein structure and substrate molecules during their initial encounter. Sulfate and phosphate ions were excluded from purification and crystallization steps. The quality of the electron density map at 2Å resolution allowed unambiguous positioning of the substrate. In three subunits of the homotetramer the C-3 phosphate group of the non-covalently bound substrate is in the 'new Pi' site. A concomitant movement of the phosphate binding loop is observed in these three subunits. In the fourth subunit the C-3 phosphate occupies an unexpected site not seen before and the phosphate binding loop remains in

  4. Spectrophotometric Study of Ternary Complex Forming Systems of Some Lanthanide Metal Ions with Eriochrome Cyanine R in Presence of Cetylpyridinium Bromide for Microdetermination

    Directory of Open Access Journals (Sweden)

    A. S. Dhepe

    2011-01-01

    Full Text Available Study of coordination compounds of lanthanide elements has received a great attention due to growing applications in science and technology. Number of chromogenic reagents form water soluble colored complexes with lanthanides. Eriochrome cyanine R (ECR a member of triphenylmethane type of dye has been reported to form green colored complexes with lanthanides and has been used for microdetermination of these metal ions. Addition of cationic surfactant, Cetylpyridinium bromide (CPB, a cationic surfactant sensitizes the color reactions of Gd(III, Tb(III, Dy(III, Ho(III and Lu(III with ECR. Formation of water soluble, highly colored ternary complexes with a considerable bathochromic shift of about 50 nm in presence of surfactant has been observed. Optimum reaction conditions and other analytical parameters were also evaluated. Stoichiometric ratio 1:3:3 of Ln: ECR: CPB are responsible for the observed rise in molar absorptivity and sensitivity. Beer’s law was obeyed between 0.50 to 13.00 ppm. Effective photometric range and molar absorptivity of these ternary complexes have been calculated. Effect of some common interfering ions on determination of these lanthanide metal ions was studied. A simple, rapid and highly sensitive spectrophotometeric method has been proposed for the determination of metal ions understudy.

  5. X-ray structure of the ternary MTX·NADPH complex of the anthrax dihydrofolate reductase: A pharmacophore for dual-site inhibitor design

    Energy Technology Data Exchange (ETDEWEB)

    Bennett, Brad C.; Wan, Qun; Ahmad, Md Faiz; Langan, Paul; Dealwis, Chris G.; (Case Western); (LANL)

    2009-11-18

    For reasons of bioterrorism and drug resistance, it is imperative to identify and develop new molecular points of intervention against anthrax. Dihydrofolate reductase (DHFR) is a highly conserved enzyme and an established target in a number of species for a variety of chemotherapeutic programs. Recently, the crystal structure of B. anthracis DHFR (baDHFR) in complex with methotrexate (MTX) was determined and, based on the structure, proposals were made for drug design strategies directed against the substrate binding site. However, little is gleaned about the binding site for NADPH, the cofactor responsible for hydride transfer in the catalytic mechanism. In the present study, X-ray crystallography at 100 K was used to determine the structure of baDHFR in complex with MTX and NADPH. Although the NADPH binding mode is nearly identical to that seen in other DHFR ternary complex structures, the adenine moiety adopts an off-plane tilt of nearly 90 deg. and this orientation is stabilized by hydrogen bonds to functionally conserved Arg residues. A comparison of the binding site, focusing on this region, between baDHFR and the human enzyme is discussed, with an aim at designing species-selective therapeutics. Indeed, the ternary model, refined to 2.3{angstrom} resolution, provides an accurate template for testing the feasibility of identifying dual-site inhibitors, compounds that target both the substrate and cofactor binding site. With the ternary model in hand, using in silico methods, several compounds were identified which could potentially form key bonding contacts in the substrate and cofactor binding sites. Ultimately, two structurally distinct compounds were verified that inhibit baDHFR at low {mu}M concentrations. The apparent K{sub d} for one of these, (2-(3-(2-(hydroxyimino)-2-(pyridine-4-yl)-6,7-dimethylquinoxalin-2-yl)-1-(pyridine-4-yl)ethanone oxime), was measured by fluorescence spectroscopy to be 5.3 {mu}M.

  6. Study on Fluorescent Properties of Europium(III) Ternary Complexes%铕(III)三元配合物荧光性质的研究

    Institute of Scientific and Technical Information of China (English)

    成义祥; 王昀初; 陶中东; 张征林

    2000-01-01

    According to fluorescent spectra of a series of Eu(III) ternary complexes in the three solvents EtOH, DMF and CH3CN, the fluorescence is stronger in the solvent CH3CN than in the solvents EtOH and DMF, and fluorescent intensity is contrary to the affinity of three solvents with rare earth ions. Center ions emit fluorescence mainly by an intramolecular energy transfer from the broad absorbing β-diketonate TTA, BTA or BA to the chelated rare earth ions.

  7. Synthesis and luminescence properties of rare earth ternary complexes consisting of Eu(Ⅲ), β-diketones and 1,10-phenanthroline

    Institute of Scientific and Technical Information of China (English)

    LIU Xingwang; WANG Na; SUO Quanling

    2008-01-01

    Three novel β-diketones (HPPP, HTPP, and HFPP) ligands were synthesized by Sonogashira coupling reaction and Claisen con-densation. The structure of β-diketones was confirmed with elemental analysis, IR, NMR and MS spectra. Three new ternary complexes consisting of Eu(Ⅲ), β-diketones, and 1,10-phenanthroline(phen) were synthesized and characterized as ThL3phen (L=PPP, TPP, FPP) with elemental analysis, chemical analysis, and IR spectra, and their luminescence properties were studied.

  8. Detection of DNA via the fluorescence quenching of Mn-doped ZnSe D-dots/doxorubicin/DNA ternary complexes system.

    Science.gov (United States)

    Gao, Xue; Niu, Lu; Su, Xingguang

    2012-01-01

    This manuscript reports a method for the detection of double-stranded DNA, based on Mn:ZnSe d-dots and intercalating agent doxorubicin (DOX). DOX can quench the photoluminescence (PL) of Mn:ZnSe d-dots through photoinduced electron transfer process, after binding with Mn:ZnSe d-dots. The addition of DNA can result in the formation of the Mn:ZnSe d-dots-DOX-DNA ternary complexes, the fluorescence of the Mn:ZnSe d-dots-DOX complexes would be further quenched by the addition of DNA, thus allowing the detection of DNA. The formation mechanism of the Mn:ZnSe d-dots-DOX-DNA ternary complexes was studied in detail in this paper. Under optimal conditions, the quenched fluorescence intensity of Mn:ZnSe d-dots-DOX system are perfectly described by Stern-Volmer equation with the concentration of hsDNA ranging from 0.006 μg mL(-1) to 6.4 μg mL(-1). The detection limit (S/N = 3) for hsDNA is 0.5 ng mL(-1). The proposed method was successfully applied to the detection of DNA in synthetic samples and the results were satisfactory.

  9. Influence of humic acid on plutonium sorption to gibbsite. Determination of Pu-humic acid complexation constants and ternary sorption studies

    Energy Technology Data Exchange (ETDEWEB)

    Zimmerman, Trevor; Powell, Brian A. [Clemson Univ., Anderson, SC (United States). Environmental Engineering and Earth Sciences; Zavarin, Mavrik [Lawrence Livermore National Laboratory, Livermore, CA (United States). Glenn T. Seaborg Institute

    2014-10-01

    In this work stability constants describing Pu(IV), Th(IV), and Np(V) binding to Leonardite humic acid (HA) were determined using a discrete pK{sub a} model. A hybrid ultra-filtration/equilibrium dialysis, ligand exchange technique was used to generate the partitioning data. Ethylenediaminetetraacetic acid (EDTA) was used as a reference ligand to allow the aqueous chemistry of the Pu(IV)-HA system to be examined over a range of pH values, while minimizing the possibility of precipitation of Pu(IV). The conditional stability constant for Pu(IV) complexation with HA determined as part of this work is logβ{sub 112} = 6.76 ± 0.14 based on the equation: Pu{sup 4+} + HL3 + 2H{sub 2}O <-> Pu(OH){sub 2}L3{sup +} + 3H{sup +} where HA is represented by HL3 (a binding site on the HA with a pK{sub a} value of 7). This value is three orders of magnitude higher than the Th(IV)-HA constant and between six and eight orders of magnitude higher than the Np(V)-HA complex. The magnitude of the stability constants and the general trend of increasing complexation strength with increasing pH is consistent with previous observations. The Pu(IV)-HA stability constants were used to model sorption of Pu(IV) to gibbsite in the presence of HA. Assuming only aqueous Pu-HA complexes and AlOH-Pu surface complexes, the model was unable to predict the observed data which exhibited greater sorption at pH 4 relative to pH 6; a phenomenon which does not occur in the absence of HA. Therefore, this study demonstrates that ternary Pu-HA-gibbsite complexes may form under low pH conditions and exhibit greater sorption than that observed in the absence of HA. Although the presence of HA may increase the solubility/aqueous concentrations of Pu in the absence of a solid phase, formation of ternary complexes may indeed retard the subsurface migration of Pu. The corollary to this finding is that increased mobility may occur if the ternary surface complex forms on a mobile colloid rather than part of the

  10. Synthesis, structural characterization and luminescent properties of a novel europium ternary complex Eu(2-A-4-CBA){sub 3}phen

    Energy Technology Data Exchange (ETDEWEB)

    Chen, Yongjie, E-mail: cyj200507@aliyun.com; Wu, Shengnan; Xing, Zhenfang; Cao, Shuang; Geng, Xiujuan; Yang, Ying; Xiao, Linjiu

    2015-11-15

    The preparation of a novel europium ternary complex with the formula of Eu(2-A-4-CBA){sub 3}phen (where, 2-A-4-CBA = 2-amino-4-chlorobenzoic acid, phen = 1,10-phenanthroline) under solvothermal condition is described. The composition and structure of the resulting complex were investigated by elemental analysis, Fourier transform infrared (FT-IR) spectroscopy. The complex is polycrystalline, and the morphology is clean and regular as revealed by scanning electron microscope (SEM). The luminescent and thermal properties of the complex were researched by fluorescence spectroscopy and thermogravimetric analysis, respectively. Of importance here is that, the room-temperature luminescence spectra of the complex show strong characteristic emission of the corresponding Eu{sup 3+}, which is attributed to the energy transfer from ligands to Eu{sup 3+} via an Antenna effect. It is also found that the complex exhibits pure red light and high color purity. In addition, the complex does not decompose until 300 °C, so it exhibits good thermal stability. - Highlights: • A novel Eu(III) complex was synthesized by solvothermal synthesis method. • The structure and properties of complex were studied. • The complex can emits pure red light and has a high color purity. • The complex does not decompose until 300 °C and it has a good thermal stability.

  11. Crosstalk between Fibroblast Growth Factor (FGF Receptor and Integrin through Direct Integrin Binding to FGF and Resulting Integrin-FGF-FGFR Ternary Complex Formation

    Directory of Open Access Journals (Sweden)

    Seiji Mori

    2013-08-01

    Full Text Available Fibroblast growth factors (FGFs play a critical role in diverse physiological processes and the pathogenesis of diseases. Integrins are involved in FGF signaling, since integrin antagonists suppress FGF signaling. This is called integrin-FGF crosstalk, while the specifics of the crosstalk are unclear. This review highlights recent findings that FGF1 directly interacts with integrin αvβ3, and the resulting integrin-FGF-fibroblast growth factor receptor (FGFR ternary complex formation is essential for FGF1-induced cell proliferation, migration and angiogenesis. An integrin-binding defective FGF1 mutant (Arg-50 to Glu, R50E is defective in ternary complex formation and in inducing cell proliferation, migration and angiogenesis, while R50E still binds to the FGF receptor and heparin. In addition, R50E suppressed tumorigenesis in vivo, while wild-type (WT FGF1 enhanced it. Thus, the direct interaction between FGF1 and integrin αvβ3 is a potential therapeutic target, and R50E is a potential therapeutic agent.

  12. Comparison of Escherichia coli tRNAPhe in the free state, in the ternary complex and in the ribosomal A and P sites by chemical probing

    DEFF Research Database (Denmark)

    Douthwaite, S; Garrett, R A; Wagner, R

    1983-01-01

    with elongation factor EF-Tu and GTP and in the ribosomal A and P sites were compared. A special procedure was devised to monitor, exclusively, tRNA molecules in the aminoacylated state. In the free tRNA, the most reactive bases are confined to the A73-C-C-A sequence of the aminoacyl stem, the anticodon loop......tRNAPheE.coli was modified at accessible guanosine, cytidine, and adenosine residues using the chemical modification method described by Peattie and Gilbert [Proc. Natl Acad. Sci. USA, 77, 4679-4689 (1980)]. Modification characteristics of the tRNA in the free state, in the ternary complex......, the D-loop and the extra loop and the results correlate well with the three-dimensional structure of tRNAPheyeast determined by X-ray studies. The pattern of reactivity was not affected either by charging the tRNA with phenylalanine or by labelling the 3' terminus with pCp. In the ternary complex...

  13. SAG101 forms a ternary complex with EDS1 and PAD4 and is required for resistance signaling against turnip crinkle virus.

    Directory of Open Access Journals (Sweden)

    Shifeng Zhu

    2011-11-01

    Full Text Available EDS1, PAD4, and SAG101 are common regulators of plant immunity against many pathogens. EDS1 interacts with both PAD4 and SAG101 but direct interaction between PAD4 and SAG101 has not been detected, leading to the suggestion that the EDS1-PAD4 and EDS1-SAG101 complexes are distinct. We show that EDS1, PAD4, and SAG101 are present in a single complex in planta. While this complex is preferentially nuclear localized, it can be redirected to the cytoplasm in the presence of an extranuclear form of EDS1. PAD4 and SAG101 can in turn, regulate the subcellular localization of EDS1. We also show that the Arabidopsis genome encodes two functionally redundant isoforms of EDS1, either of which can form ternary complexes with PAD4 and SAG101. Simultaneous mutations in both EDS1 isoforms are essential to abrogate resistance (R protein-mediated defense against turnip crinkle virus (TCV as well as avrRps4 expressing Pseudomonas syringae. Interestingly, unlike its function as a PAD4 substitute in bacterial resistance, SAG101 is required for R-mediated resistance to TCV, thus implicating a role for the ternary complex in this defense response. However, only EDS1 is required for HRT-mediated HR to TCV, while only PAD4 is required for SA-dependent induction of HRT. Together, these results suggest that EDS1, PAD4 and SAG101 also perform independent functions in HRT-mediated resistance.

  14. Spectrophotometric determination of Mercury (II by simultaneous micelle mediated extraction through ternary complex formation in water samples

    Directory of Open Access Journals (Sweden)

    Farzin Nekouei

    2014-06-01

    Full Text Available In this study, a micelle mediated extraction procedure for preconcentration of trace quantities of Hg(II as a prior step to its simultaneous spectrophotometric determination has been developed. The method is based on a ternary ion-association of Hg(II, Xylidyl Blue (XB and cationic surfactant (CTAB. Major factors affecting the efficiency of the method has been studied. The limit of detection (LOD under optimum conditions based on 3Sb was 4.65 ng mL-1. The proposed method has been applied for determination of trace amount of mercury in water samples with satisfactory results.

  15. A new ternary copper(II) complex derived from 2-(2'-pyridyl)benzimidazole and glycylglycine: synthesis, characterization, DNA binding and cleavage, antioxidation and HSA interaction.

    Science.gov (United States)

    Fu, Xia-Bing; Lin, Zi-Hua; Liu, Hai-Feng; Le, Xue-Yi

    2014-03-25

    A new ternary copper(II)-dipeptide complex [Cu(glygly)(HPB)(Cl)]⋅2H2O (glygly=glycylglycine anion, HPB=2-(2'-pyridyl)benzimidazole) has been synthesized and characterized. The DNA interaction of the complex was studied by spectroscopic methods, viscosity, and electrophoresis measurements. The antioxidant activity was also investigated using the pyrogallol autoxidation assay. Besides, the interaction of the complex with human serum albumin (HSA) in vitro was examined by multispectroscopic techniques. The complex partially intercalated to CT-DNA with a high binding constant (Kb=7.28×10(5) M(-1)), and cleaved pBR322 DNA efficiently via an oxidative mechanism in the presence of Vc, with the HO· and O2(-) as the active species, and the SOD as a promoter. Furthermore, the complex shows a considerable SOD-like activity with the IC50 value of 3.8386 μM. The complex exhibits desired binding affinity to HSA, in which hydrogen bond or vander Waals force played a major role. The alterations of HSA secondary structure induced by the complex were confirmed by UV-visible, CD, synchronous fluorescence and 3D fluorescence spectroscopy.

  16. Ternary complex formation between AmtB, GlnZ and the nitrogenase regulatory enzyme DraG reveals a novel facet of nitrogen regulation in bacteria.

    Science.gov (United States)

    Huergo, Luciano F; Merrick, Mike; Pedrosa, Fábio O; Chubatsu, Leda S; Araujo, Luíza M; Souza, Emanuel M

    2007-12-01

    Ammonium movement across biological membranes is facilitated by a class of ubiquitous channel proteins from the Amt/Rh family. Amt proteins have also been implicated in cellular responses to ammonium availability in many organisms. Ammonium sensing by Amt in bacteria is mediated by complex formation with cytosolic proteins of the P(II) family. In this study we have characterized in vitro complex formation between the AmtB and P(II) proteins (GlnB and GlnZ) from the diazotrophic plant-associative bacterium Azospirillum brasilense. AmtB-P(II) complex formation only occurred in the presence of adenine nucleotides and was sensitive to 2-oxoglutarate when Mg(2+) and ATP were present, but not when ATP was substituted by ADP. We have also shown in vitro complex formation between GlnZ and the nitrogenase regulatory enzyme DraG, which was stimulated by ADP. The stoichiometry of this complex was 1:1 (DraG monomer : GlnZ trimer). We have previously reported that in vivo high levels of extracellular ammonium cause DraG to be sequestered to the cell membrane in an AmtB and GlnZ-dependent manner. We now report the reconstitution of a ternary complex involving AmtB, GlnZ and DraG in vitro. Sequestration of a regulatory protein by the membrane-bound AmtB-P(II) complex defines a new regulatory role for Amt proteins in Prokaryotes.

  17. Synthesis and Structure of a Ternary Copper(II) Complex with Mixed Ligands of Diethylenetriamine and Picrate: DNA/Protein-Binding Property and In Vitro Anticancer Activity Studies.

    Science.gov (United States)

    Shi, Ya-Ning; Zheng, Kang; Zhu, Ling; Li, Yan-Tuan; Wu, Zhi-Yong; Yan, Cui-Wei

    2015-05-01

    Based on the importance of the design and synthesis of transition metal complexes with noncovalent DNA/protein-binding abilities in the field of metallo pharmaceuticals, a new mononuclear ternary copper(II) complex with mixed ligands of diethylenetriamine (dien) and picrate anion (pic), identified as [Cu(dien)(pic)](pic), was synthesized and characterized by elemental analysis, molar conductivity measurement, infrared spectrum, electronic spectral studies, and single-crystal X-ray diffractometry. The structure analysis reveals that the copper(II) complex crystallizes in the monoclinic space group P21 /c, and the copper(II) ion has a distorted square pyramidal coordination geometry. A two-dimensional supramolecular structure is formed through hydrogen bonds. The DNA/bovine serum albumin (BSA)-binding properties of the complex are explored, indicating that the complex can interact with herring sperm DNA via intercalation mode and bind to BSA responsible for quenching of tryptophan fluorescence by static quenching mechanism. The in vitro anticancer activity shows that the copper(II) complex is active against the selected tumor cell lines.

  18. Bacillus cereus Fnr binds a [4Fe-4S] cluster and forms a ternary complex with ResD and PlcR

    Directory of Open Access Journals (Sweden)

    Esbelin Julia

    2012-06-01

    Full Text Available Abstract Background Bacillus cereus is a facultative anaerobe that causes diarrheal disease in humans. Diarrheal syndrome may result from the secretion of various virulence factors including hemolysin BL and nonhemolytic enterotoxin Nhe. Expression of genes encoding Hbl and Nhe is regulated by the two redox systems, ResDE and Fnr, and the virulence regulator PlcR. B. cereus Fnr is a member of the Crp/Fnr family of iron-sulfur (Fe-S proteins. Only its apo-form has so far been studied. A major goal in deciphering the Fnr-dependent regulation of enterotoxin genes is thus to obtain and characterize holoFnr. Results Fnr has been subjected to in vitro Fe-S cluster reconstitution under anoxic conditions. UV-visible and EPR spectroscopic analyses together with the chemical estimation of the iron content indicated that Fnr binds one [4Fe-4S]2+ cluster per monomer. Atmospheric O2 causes disassembly of the Fe-S cluster, which exhibited a half-life of 15 min in air. Holo- and apoFnr have similar affinities for the nhe and hbl promoter regions, while holoFnr has a higher affinity for fnr promoter region than apoFnr. Both the apo- and holo-form of Fnr interact with ResD and PlcR to form a ternary complex. Conclusions Overall, this work shows that incorporation of the [4Fe-4S]2+ cluster is not required for DNA binding of Fnr to promoter regions of hbl and nhe enterotoxin genes or for the formation of a ternary complex with ResD and PlcR. This points to some new unusual properties of Fnr that may have physiological relevance in the redox regulation of enterotoxin gene regulation.

  19. Immunohistochemical localization of DPP10 in rat brain supports the existence of a Kv4/KChIP/DPPL ternary complex in neurons.

    Science.gov (United States)

    Wang, Wan-Chen; Cheng, Chau-Fu; Tsaur, Meei-Ling

    2015-03-01

    Subthreshold A-type K(+) currents (ISA s) have been recorded from the cell bodies of hippocampal and neocortical interneurons as well as neocortical pyramidal neurons. Kv4 channels are responsible for the somatodendritic ISA s. It has been proposed that neuronal Kv4 channels are ternary complexes including pore-forming Kv4 subunits, K(+) channel-interacting proteins (KChIPs), and dipeptidyl peptidase-like proteins (DPPLs). However, colocalization evidence was still lacking. The distribution of DPP10 mRNA in rodent brain has been reported but its protein localization remains unknown. In this study, we generated a DPP10 antibody to label DPP10 protein in adult rat brain by immunohistochemistry. Absent from glia, DPP10 proteins appear mainly in the cell bodies of DPP10(+) neurons, not only at the plasma membrane but also in the cytoplasm. At least 6.4% of inhibitory interneurons in the hippocampus coexpressed Kv4.3, KChIP1, and DPP10, with the highest density in the CA1 strata alveus/oriens/pyramidale and the dentate hilus. Colocalization of Kv4.3/KChIP1/DPP10 was also detected in at least 6.9% of inhibitory interneurons scattered throughout the neocortex. Both hippocampal and neocortical Kv4.3/KChIP1/DPP10(+) inhibitory interneurons expressed parvalbumin or somatostatin, but not calbindin or calretinin. Furthermore, we found colocalization of Kv4.2/Kv4.3/KChIP3/DPP10 in neocortical layer 5 pyramidal neurons and olfactory bulb mitral cells. Together, although DPP10 is also expressed in some brain neurons lacking Kv4 (such as parvalbumin- and somatostatin-positive Golgi cells in the cerebellum), colocalization of DPP10 with Kv4 and KChIP at the plasma membrane of ISA -expressing neuron somata supports the existence of Kv4/KChIP/DPPL ternary complex in vivo.

  20. Synthesis and characterization of low-valence actinide phosphide tellurides and ternary selenium-halide iridium complexes; Synthese und Charakterisierung niedervalenter Actinoidphosphidtelluride und ternaerer Selen-Halogenid-Komplexe des Iridiums

    Energy Technology Data Exchange (ETDEWEB)

    Stolze, Karoline

    2016-04-07

    The thesis on the synthesis and characterization of low-valence actinide phosphide tellurides and ternary selenium-halide iridium complexes includes two parts: a description of the experimental synthesis of UPTe and U2PTe2O and ThPTe and the synthesis of selenium-chloride iridium complexes and selenium-bromide iridium complexes. The characterization included X-ray diffraction and phase studies.

  1. Pattern Avoidance in Ternary Trees

    CERN Document Server

    Gabriel, Nathan; Pudwell, Lara; Tay, Samuel

    2011-01-01

    This paper considers the enumeration of ternary trees (i.e. rooted ordered trees in which each vertex has 0 or 3 children) avoiding a contiguous ternary tree pattern. We begin by finding recurrence relations for several simple tree patterns; then, for more complex trees, we compute generating functions by extending a known algorithm for pattern-avoiding binary trees. Next, we present an alternate one-dimensional notation for trees which we use to find bijections that explain why certain pairs of tree patterns yield the same avoidance generating function. Finally, we compare our bijections to known "replacement rules" for binary trees and generalize these bijections to a larger class of trees.

  2. Thermokinetics on the Reaction of Formation of the Ternary Complex Nd[(C5H8NS2)3(C12H8N2)

    Institute of Scientific and Technical Information of China (English)

    FAN,Xue-Zhong(樊学忠); MENG,Xiang-Xin(孟祥鑫); CHEN,San-Ping(陈三平); JIAO,Bao-Juan(焦宝娟); REN,Yi-Xia(任宜霞); GAO,Sheng-Li(高胜利); SHI,Qi-Zhen(史启祯)

    2004-01-01

    The title ternary complex Nd[(C5H8NS2)3(C12H8N2)] has been synthesized in absolute ethanol by the reaction of atmosphere without any cautions against moisture. The bonding characteristics of the complex were characterized by IR, showing that Nd3+ is bonded with sulfur atom in the APDC and coordinated with nitrogen atom in the phen.TG-DTG investigation indicates that the title complex was decomposed into Nd2S3 and deposited carbon in one step where Nd2S3 predominated in the final products. The enthalpy change of formation of the reaction on the title complex in liquid-phase has been determined by a microcalorimeter. Thermodynamic parameters (the activation enthalpy, the activation entropy and the activation free energy) and kinetics parameters (the rate constant, the apparent activation energy, the pre-exponential constant and the reaction order) of the title reaction have been calculated. The enthalpy change of the solid-phase reaction has been obtained by a thermochemistry cycle.

  3. Synthesis and Crystal Structure of a New Ternary Complex of Nickel(Ⅱ) with L-Aspartic Acid and 1,10-Phenanthroline

    Institute of Scientific and Technical Information of China (English)

    马录芳; 梁福沛; 覃海错; 胡瑞祥; 张漫波

    2004-01-01

    A new ternary complex of nickel(Ⅱ) with L-aspartate (L-Asp) and 1, 10-phenanthroline(Phen), [Ni3(L-Asp)(Phen)5(H2O)3](ClO4)4.4.75H2O, has been synthesized in a mixed solvent of H2OC2H5OH at the pH value of 3. It crystallizes in triclinic, space group P-1 with a =11.861(2), b = 18.384(4), c = 19.746(3)(°A), α = 107.68(1), β = 105.94(1), γ= 103.41(2)°, V =3703.6(11) (°A)3, Mr = 1745.66, Z = 2, Dc =1.565 g/cm3, u = 0.989 mm-1, F(000) = 1791, R = 0.0643and wR = 0.1611. The complex contains two cations, binuclear [Ni2(L-Asp)(Phen)3(H2O)]2+ and mononu- clear [Ni(Phen)2(H2O)2]2+. All the nickel ions in the complex are six-coordinated with a distorted octahedral geometry, but the coordination environments for them are different. There exist hydrogen bonds and π-π stacking interactions in the complex.

  4. Delivery of siRNA using ternary complexes containing branched cationic peptides: the role of peptide sequence, branching and targeting.

    Science.gov (United States)

    Kudsiova, Laila; Welser, Katharina; Campbell, Frederick; Mohammadi, Atefeh; Dawson, Natalie; Cui, Lili; Hailes, Helen C; Lawrence, M Jayne; Tabor, Alethea B

    2016-03-01

    Ternary nanocomplexes, composed of bifunctional cationic peptides, lipids and siRNA, as delivery vehicles for siRNA have been investigated. The study is the first to determine the optimal sequence and architecture of the bifunctional cationic peptide used for siRNA packaging and delivery using lipopolyplexes. Specifically three series of cationic peptides of differing sequence, degrees of branching and cell-targeting sequences were co-formulated with siRNA and vesicles prepared from a 1 : 1 molar ratio of the cationic lipid DOTMA and the helper lipid, DOPE. The level of siRNA knockdown achieved in the human alveolar cell line, A549-luc cells, in both reduced serum and in serum supplemented media was evaluated, and the results correlated to the nanocomplex structure (established using a range of physico-chemical tools, namely small angle neutron scattering, transmission electron microscopy, dynamic light scattering and zeta potential measurement); the conformational properties of each component (circular dichroism); the degree of protection of the siRNA in the lipopolyplex (using gel shift assays) and to the cellular uptake, localisation and toxicity of the nanocomplexes (confocal microscopy). Although the size, charge, structure and stability of the various lipopolyplexes were broadly similar, it was clear that lipopolyplexes formulated from branched peptides containing His-Lys sequences perform best as siRNA delivery agents in serum, with protection of the siRNA in serum balanced against efficient release of the siRNA into the cytoplasm of the cell.

  5. Low- and room-temperature X-ray structures of protein kinase A ternary complexes shed new light on its activity

    Energy Technology Data Exchange (ETDEWEB)

    Kovalevsky, Andrey Y., E-mail: ayk@lanl.gov; Johnson, Hanna [Los Alamos National Laboratory, PO Box 1663, MS M888, Los Alamos, NM 87545 (United States); Hanson, B. Leif [University of Toledo, 2801 West Bancroft Street, Toledo, OH 43606 (United States); Waltman, Mary Jo; Fisher, S. Zoe [Los Alamos National Laboratory, PO Box 1663, MS M888, Los Alamos, NM 87545 (United States); Taylor, Susan [University of San Diego, 9500 Gilman Drive, Leichtag 415, La Jolla, CA 92093 (United States); Langan, Paul [Oak Ridge National Laboratory, PO Box 2008, MS 6475, Oak Ridge, TN 37831 (United States); Los Alamos National Laboratory, PO Box 1663, MS M888, Los Alamos, NM 87545 (United States)

    2012-07-01

    ATP bound in the active site of protein kinase A is readily hydrolysed to ADP and free phosphate by X-ray irradiation at room temperature. The phosphate ion observed in the active site causes a dramatic conformational change of the bound peptide inhibitor. Post-translational protein phosphorylation by protein kinase A (PKA) is a ubiquitous signalling mechanism which regulates many cellular processes. A low-temperature X-ray structure of the ternary complex of the PKA catalytic subunit (PKAc) with ATP and a 20-residue peptidic inhibitor (IP20) at the physiological Mg{sup 2+} concentration of ∼0.5 mM (LT PKA–MgATP–IP20) revealed a single metal ion in the active site. The lack of a second metal in LT PKA–MgATP–IP20 renders the β- and γ-phosphoryl groups of ATP very flexible, with high thermal B factors. Thus, the second metal is crucial for tight positioning of the terminal phosphoryl group for transfer to a substrate, as demonstrated by comparison of the former structure with that of the LT PKA–Mg{sub 2}ATP–IP20 complex obtained at high Mg{sup 2+} concentration. In addition to its kinase activity, PKAc is also able to slowly catalyze the hydrolysis of ATP using a water molecule as a substrate. It was found that ATP can be readily and completely hydrolyzed to ADP and a free phosphate ion in the crystals of the ternary complex PKA–Mg{sub 2}ATP–IP20 by X-ray irradiation at room temperature. The cleavage of ATP may be aided by X-ray-generated free hydroxyl radicals, a very reactive chemical species, which move rapidly through the crystal at room temperature. The phosphate anion is clearly visible in the electron-density maps; it remains in the active site but slides about 2 Å from its position in ATP towards Ala21 of IP20, which mimics the phosphorylation site. The phosphate thus pushes the peptidic inhibitor away from the product ADP, while resulting in dramatic conformational changes of the terminal residues 24 and 25 of IP20. X-ray structures of

  6. {sup 99m}Tc-HYNIC-derivatized ternary ligand complexes for {sup 99m}Tc-labeled polypeptides with low in vivo protein binding

    Energy Technology Data Exchange (ETDEWEB)

    Ono, Masahiro; Arano, Yasushi E-mail: arano@p.chiba-u.ac.jp; Mukai, Takahiro; Fujioka, Yasushi; Ogawa, Kazuma; Uehara, Tomoya; Saga, Tsuneo; Konishi, Junji; Saji, Hideo

    2001-04-01

    6-Hydrazinopyridine-3-carboxylic acid (HYNIC) is a representative agent used to prepare technetium-99m ({sup 99m}Tc)-labeled polypeptides with tricine as a coligand. However, {sup 99m}Tc-HYNIC-labeled polypeptides show delayed elimination rates of the radioactivity not only from the blood but also from nontarget tissues such as the liver and kidney. In this study, a preformed chelate of tetrafluorophenol (TFP) active ester of [{sup 99m}Tc](HYNIC)(tricine)(benzoylpyridine: BP) ternary complex was synthesized to prepare {sup 99m}Tc-labeled polypeptides with higher stability against exchange reactions with proteins in plasma and lysosomes using the Fab fragment of a monoclonal antibody and galactosyl-neoglycoalbumin (NGA) as model polypeptides. When incubated in plasma, [{sup 99m}Tc](HYNIC-Fab)(tricine)(BP) showed significant reduction of the radioactivity in high molecular weight fractions compared with [{sup 99m}Tc](HYNIC-Fab)(tricine){sub 2.} When injected into mice, [{sup 99m}Tc](HYNIC-NGA)(tricine)(BP) was metabolized to [{sup 99m}Tc](HYNIC-lysine)(tricine)(BP) in the liver with no radioactivity detected in protein-bound fractions in contrast to the observations with [{sup 99m}Tc](HYNIC-NGA)(tricine){sub 2.} In addition, [{sup 99m}Tc](HYNIC-NGA)(tricine)(BP) showed significantly faster elimination rates of the radioactivity from the liver as compared with [{sup 99m}Tc](HYNIC-NGA)(tricine){sub 2.} Similar results were observed with {sup 99m}Tc-labeled Fab fragments where [{sup 99m}Tc](HYNIC-Fab)(tricine)(BP) exhibited significantly faster elimination rates of the radioactivity not only from the blood but also from the kidney. These findings indicated that conjugation of [{sup 99m}Tc](HYNIC)(tricine)(BP) ternary ligand complex to polypeptides accelerated elimination rates of the radioactivity from the blood and nontarget tissues due to low binding of the [{sup 99m}Tc](HYNIC)(tricine)(BP) complex with proteins in the blood and in the lysosomes. Such characteristics

  7. A novel ternary ligand system useful for preparation of cationic (99m)Tc-diazenido complexes and (99m)Tc-labeling of small biomolecules.

    Science.gov (United States)

    Kim, Young-Seung; He, Zhengjie; Hsieh, Wen-Yuan; Liu, Shuang

    2006-01-01

    This report describes a novel ternary ligand system composed of a phenylhydrazine, a crown ether-containing dithiocarbamate (DTC), and a PNP-type bisphosphine (PNP). The combination of three different ligands with (99m)Tc results in cationic (99m)Tc-diazenido complexes, [(99m)Tc(NNAr)(DTC)(PNP)]+, with potential radiopharmaceuticals for heart imaging. Synthesis of cationic (99m)Tc-diazenido complexes can be accomplished in two steps. For example, the reaction of phenylhydrazine with (99m)TcO4- at 100 degrees C in the presence of excess stannous chloride and 1,2-diaminopropane-N,N,N',N'-tetraacetic acid (PDTA) results in the [(99m)Tc(NNPh)(PDTA)n] intermediate, which then reacts with sodium N-(dithiocarbamato)-2-aminomethyl-15-Crown-5 (L4) and N,N-bis[2-(bis(3-ethoxypropyl)phosphino)ethyl]ethoxyethylamine (PNP6) at 100 degrees C for 15 min to give the complex, [(99m)Tc(NNPh)(L4)(PNP6)]+ in high yield (>90%). Cationic complexes [(99m)Tc(NNPh)(DTC)(PNP)]+ are stable for > or = 6 h. Their composition was determined to be 1:1:1:1 for Tc:NNPh:DTC:PNP using the mixed-ligand experiments on the tracer ((99m)Tc) level and was further confirmed by the ESI-MS spectral data of a model compound [Re(NNPh)(L4)(L6)]+. It was found that both DTCs and bisphosphines have a significant impact on the lipophilicity of their cationic (99m)Tc-diazenido complexes. Results from a (99m)Tc-labeling efficiency experiment showed that 4-hydrazinobenzoic acid (HYBA) might be useful as a bifunctional coupling agent for (99m)Tc-labeling of small biomolecules. However, the (99m)Tc-labeling efficiency of HYBA is much lower than that of 6-hydrazinonicotinic acid (HYNIC) with tricine and trisodium triphenylphosphine-3,3',3''-trisulfonate (TPPTS) as coligands.

  8. Structure of the Dual-Mode Wnt Regulator Kremen1 and Insight into Ternary Complex Formation with LRP6 and Dickkopf.

    Science.gov (United States)

    Zebisch, Matthias; Jackson, Verity A; Zhao, Yuguang; Jones, E Yvonne

    2016-09-01

    Kremen 1 and 2 have been identified as co-receptors for Dickkopf (Dkk) proteins, hallmark secreted antagonists of canonical Wnt signaling. We present here three crystal structures of the ectodomain of human Kremen1 (KRM1ECD) at resolutions between 1.9 and 3.2 Å. KRM1ECD emerges as a rigid molecule with tight interactions stabilizing a triangular arrangement of its Kringle, WSC, and CUB structural domains. The structures reveal an unpredicted homology of the WSC domain to hepatocyte growth factor. We further report the general architecture of the ternary complex formed by the Wnt co-receptor Lrp5/6, Dkk, and Krm, determined from a low-resolution complex crystal structure between β-propeller/EGF repeats (PE) 3 and 4 of the Wnt co-receptor LRP6 (LRP6PE3PE4), the cysteine-rich domain 2 (CRD2) of DKK1, and KRM1ECD. DKK1CRD2 is sandwiched between LRP6PE3 and KRM1Kringle-WSC. Modeling studies supported by surface plasmon resonance suggest a direct interaction site between Krm1CUB and Lrp6PE2.

  9. Spectroscopic, solvent influence and thermal studies of ternary copper(II) complexes of diester and dinitrogen base ligands.

    Science.gov (United States)

    Emara, Adel A A; Abu-Hussein, Azza A A; Taha, Ahmed A; Mahmoud, Nelly H

    2010-10-15

    New mixed-ligand copper(II) complexes containing the bidentate dinitrogen ligands [N,N,N',N'-tetramethylethylenediamine (tmen), 2,2'-bipyridine (bipy) and 1,10-phenanthroline (phen)] and the bidentate dioxygen ligands [diethylmalonate (DEM), ethylacetoacetate (EAA) and ethylbenzoylacetate (EBA)] were prepared. The complexes were characterized by elemental analysis, infrared, mass and ESR spectral data, magnetic and molar conductance measurements and thermal gravimetric analysis. From the investigation, the geometries of the complexes are square planar for perchlorate complexes and a square pyramid or octahedral for the nitrate complexes. Solvatochromic behavior of the Cu(II) complexes indicates strong solvatochromism of their solutions in polar and non-polar solvents. The observed solvatochromism is due to the solute-solvent interaction between the chelate cation and the solvent molecules.

  10. Thrombin induces Egr-1 expression in fibroblasts involving elevation of the intracellular Ca2+ concentration, phosphorylation of ERK and activation of ternary complex factor

    Directory of Open Access Journals (Sweden)

    Thiel Gerald

    2009-05-01

    Full Text Available Abstract Background The serine protease thrombin catalyzes fibrin clot formation by converting fibrinogen into fibrin. Additionally, thrombin stimulation leads to an activation of stimulus-responsive transcription factors in different cell types, indicating that the gene expression pattern is changed in thrombin-stimulated cells. The objective of this study was to analyze the signaling cascade leading to the expression of the zinc finger transcription factor Egr-1 in thrombin-stimulated lung fibroblasts. Results Stimulation of 39M1-81 fibroblasts with thrombin induced a robust and transient biosynthesis of Egr-1. Reporter gene analysis revealed that the newly synthesized Egr-1 was biologically active. The signaling cascade connecting thrombin stimulation with Egr-1 gene expression required elevated levels of cytosolic Ca2+, the activation of diacylgycerol-dependent protein kinase C isoenzymes, and the activation of extracellular signal-regulated protein kinase (ERK. Stimulation of the cells with thrombin triggered the phosphorylation of the transcription factor Elk-1. Expression of a dominant-negative mutant of Elk-1 completely prevented Egr-1 expression in stimulated 39M1-81 cells, indicating that Elk-1 or related ternary complex factors connect the intracellular signaling cascade elicited by activation of protease-activated receptors with transcription of the Egr-1 gene. Lentiviral-mediated expression of MAP kinase phosphatase-1, a dual-specific phosphatase that dephosphorylates and inactivates ERK in the nucleus, prevented Elk-1 phosphorylation and Egr-1 biosynthesis in thrombin stimulated 39M1-81 cells, confirming the importance of nuclear ERK and Elk-1 for the upregulation of Egr-1 expression in thrombin-stimulated lung fibroblasts. 39M1-81 cells additionally express M1 muscarinic acetylcholine receptors. A comparison between the signaling cascades induced by thrombin or carbachol showed no differences, except that signal transduction via M

  11. Synthesis, Antibacterial Activities and Nuclease Properties of Ternary Copper(II) Complex Containing 2-(2'-Pyridyl)benzothiazole and Glycinate%Synthesis, Antibacterial Activities and Nuclease Properties of Ternary Copper(II) Complex Containing 2-(2'-Pyridyl)benzothiazole and Glycinate

    Institute of Scientific and Technical Information of China (English)

    Lu, Yanmei; Chen, Yongheng; ou, Zhibin; Chen, Shi; Zhuang, Chuxiong; Le, Xueyi

    2012-01-01

    A new ternary complex [Cu(PBT)(Gly)(H2O)]ClO4 (PBT=2-(2'-pyridyl)benzothiazole, and Gly=glycinate) has been synthesized and characterized by elemental analysis, molar conductivity, and IR methods. The complex, structurally characterized by single-crystal X-ray crystallography, shows a slightly distorted square-pyramidal coordination geometry in which two nitrogen atoms of PBT and the carboxylate oxygen atom O and the amino nitrogen atom N of Gly bind at the basal plane, a water molecule is coordinated at the apical position. The complex, Cu(ClO4)2 and flee PBT were each tested for their ability to inhibit the growth of two Gram(--) (Escherichia coil, Salmonella) and two Gram(+) (Bacillus subtilis, Staphylococcus aureus) microorganisms. The complex showed good antibacterial activities against the microorganisms compared with free PBT and Cu(C104)2. The interaction between the complex and calf thymus DNA in aqueous solution was investigated using electronic spectroscopy, fluorescence spectroscopy, circular dichroic spectroscopy, and viscosity measurements. Results suggest that the complex could bind to DNA by an intercalative mode. In addition, the result of agarose gel electrophoresis showed that the complex can cleave the plasmid DNA by hydroxyl radicals and singlet oxygen-like species under the condition of physiological pH and room temperature.

  12. Fluorescent studies on the interaction of DNA and ternary lanthanide complexes with cinnamic acid-phenanthroline and antibacterial activities testing.

    Science.gov (United States)

    Sun, Hui-Juan; Wang, Ai-Ling; Chu, Hai-Bin; Zhao, Yong-Liang

    2015-03-01

    Twelve lanthanide complexes with cinnamate (cin(-) ) and 1,10-phenanthroline (phen) were synthesized and characterized. Their compositions were assumed to be RE(cin)3 phen (RE(3+)  = La(3+) , Pr(3+) , Nd(3+) , Sm(3+) , Eu(3+) , Gd(3+) , Tb(3+) , Dy(3+) , Ho(3+) , Tm(3+) , Yb(3+) , Lu(3+) ). The interaction mode between the complexes and DNA was investigated by fluorescence quenching experiment. The results indicated the complexes could bind to DNA and the main binding mode is intercalative binding. The fluorescence quenching constants of the complexes increased from La(cin)3 phen to Lu(cin)3 phen. Additionally, the antibacterial activity testing showed that the complexes exhibited excellent antibacterial ability against Escherichia coli, and the changes of antibacterial ability are in agreement with that of the fluorescence quenching constants.

  13. Stimulation of the 150-kilodalton insulin-like growth factor-binding protein-3 ternary complex by continuous and pulsatile patterns of growth hormone (GH) administration in GH-deficient patients

    DEFF Research Database (Denmark)

    Laursen, Torben; Flyvbjerg, Allan; Jørgensen, Jens Otto Lunde

    2000-01-01

    Abstract In the circulation insulin-like growth factor I (IGF-I), IGF-binding protein 3 (IGFBP-3), and the acid-labile subunit (ALS) form a 150-kDa ternary complex that is of importance for the regulation of IGF-I bioactivity. GH administration is known to increase each of the single components...... of the ternary complex, and in GH-deficient rats formation of the 150-kDa complex is induced more by continuous than by pulsatile GH patterns. The aim of the present studies was to study the effects of the GH administration pattern on the formation of the 150-kDa ternary complex in humans. A fixed total GH dose...... (2 IU/m2-24 h) was administered iv randomly as 1) continuous infusion or 2) eight bolus injections to five GH-deficient patients over a period of 24 h. GH administration significantly increased serum IGF-I and IGFBP-3 levels and the IGF-I/IGFBP-3 ratio. IGF-I levels increased most pronouncedly after...

  14. Synthesis, characterization, electrochemical studies and DFT calculations of amino acids ternary complexes of copper (II) with isonitrosoacetophenone. Biological activities

    Science.gov (United States)

    Tidjani-Rahmouni, Nabila; Bensiradj, Nour el Houda; Djebbar, Safia; Benali-Baitich, Ouassini

    2014-10-01

    Three mixed complexes having formula [Cu(INAP)L(H2O)2] where INAP = deprotonated isonitrosoacetophenone and L = deprotonated amino acid such as histidine, phenylalanine and tryptophan have been synthesized. They have also been characterized using elemental analyses, molar conductance, UV-Vis, IR and ESR spectra. The value of molar conductance indicates them to be non-electrolytes. The spectral studies support the binding of the ligands with two N and two O donor sites to the copper (II) ion, giving an arrangement of N2O2 donor groups. Density Functional Theory (DFT) calculations were applied to evaluate the cis and trans coordination modes of the two water molecules. The trans form was shown to be energetically more stable than the cis one. The ESR data indicate that the covalent character of the metal-ligand bonding in the copper (II) complexes increases on going from histidine to phenylalanine to tryptophan. The electrochemical behavior of the copper (II) complexes was determined by cyclic voltammetry which shows that the chelate structure and electron donating effects of the ligands substituent are among the factors influencing the redox potentials of the complexes. The antimicrobial activities of the complexes were evaluated against several pathogenic microorganisms to assess their antimicrobial potentials. The copper complexes were found to be more active against Gram-positive than Gram-negative bacteria. Furthermore, the antioxidant efficiencies of the metal complexes were determined by 2,2-diphenyl-1-picrylhydrazyl (DPPH) radical scavenging activity. The antioxidant activity of the complexes indicates their moderate scavenging activity against the radical DPPH.

  15. Direct and allosteric inhibition of the FGF2/HSPGs/FGFR1 ternary complex formation by an antiangiogenic, thrombospondin-1-mimic small molecule.

    Directory of Open Access Journals (Sweden)

    Katiuscia Pagano

    Full Text Available Fibroblast growth factors (FGFs are recognized targets for the development of therapies against angiogenesis-driven diseases, including cancer. The formation of a ternary complex with the transmembrane tyrosine kinase receptors (FGFRs, and heparan sulphate proteoglycans (HSPGs is required for FGF2 pro-angiogenic activity. Here by using a combination of techniques including Nuclear Magnetic Resonance, Molecular Dynamics, Surface Plasmon Resonance and cell-based binding assays we clarify the molecular mechanism of inhibition of an angiostatic small molecule, sm27, mimicking the endogenous inhibitor of angiogenesis, thrombospondin-1. NMR and MD data demonstrate that sm27 engages the heparin-binding site of FGF2 and induces long-range dynamics perturbations along FGF2/FGFR1 interface regions. The functional consequence of the inhibitor binding is an impaired FGF2 interaction with both its receptors, as demonstrated by SPR and cell-based binding assays. We propose that sm27 antiangiogenic activity is based on a twofold-direct and allosteric-mechanism, inhibiting FGF2 binding to both its receptors.

  16. Sensitive Determination of Uranium in Natural Waters Using UV-Vis Spectrometry After Preconcentration by Ion-Imprinted Polymer-Ternary Complexes.

    Science.gov (United States)

    Bicim, Tulin; Yaman, Mehmet

    2016-07-01

    The main purpose of this study was to achieve a substantial increase in the sensitivity of the uranium determination using UV-Vis spectrometry. To achieve this goal, ion-imprinted polymers were prepared for the uranyl (imprint) ion by the formation of a ternary (salicylaldoxime and 4-vinylpyridine) complex in 2-methoxy ethanol (porogen) following copolymerization with methacrylic acid. The synthesized polymers were characterized by FTIR analysis and thermogravimetric analysis. In the preconcentration step, the optimal pH was determined to be between values of 3.5 and 6.5. The adsorbed UO2(2+) was completely eluted by 10 mL of 3.0 mol L(-1) HClO4. The developed method was applied to uranium (VI) determination in natural water samples. By using the initial volume of 500 mL and final volume of 5 mL, a concentration of 1 μg L(-1) can be determined by applying the developed method in this study.

  17. Impact of natural organic matter on arsenic removal by modified granular natural siderite: Evidence of ternary complex formation by HPSEC-UV-ICP-MS.

    Science.gov (United States)

    Li, Fulan; Guo, Huaming; Zhou, Xiaoqian; Zhao, Kai; Shen, Jiaxing; Liu, Fei; Wei, Chao

    2017-02-01

    High arsenic (As) groundwater usually has high concentrations of natural organic matter (NOM). Effects of NOM on arsenic adsorption were investigated to evaluate the efficiency of modified granular natural siderite (MGNS) as an adsorbent for groundwater arsenic remediation. Humic and fulvic acids (HA/FA) were selected as model NOM compounds. In batch tests, HA or FA was either first adsorbed onto the MGNS, or applied together with dissolved arsenic to investigate effects of both adsorbed and dissolved NOM on arsenic removal. The kinetic data showed no significant effects of both adsorbed and dissolved HA/FA on As(III) adsorption. However, As(V) removal was inhibited, whereby the adsorbed NOM compounds had greater inhibitory effect. The inhibitory effect on As(V) removal increased with increasing NOM concentrations. FA exhibited higher inhibitory effect than HA at the same concentration. Steric Exclusion Chromatography-HPLC (SEC-HPLC), and High-Performance Size Exclusion Chromatography-UV-Inductively Coupled Plasma Mass Spectrometry (HPSEC-UV-ICP-MS) revealed that As(V) removal was mostly achieved by the oxyanion adsorption and adversely affected by dissolved FA via competitive adsorption for surface sites. In addition to oxyanion adsorption, removal of As(V) was related to scavenging of ternary HA-As-Fe complexes, which led to the less inhibitory effect of dissolved HA on As(V) removal than dissolved FA via competitive adsorption.

  18. The ternary structure of the double-headed arrowhead protease inhibitor API-A complexed with two trypsins reveals a novel reactive site conformation.

    Science.gov (United States)

    Bao, Rui; Zhou, Cong-Zhao; Jiang, Chunhui; Lin, Sheng-Xiang; Chi, Cheng-Wu; Chen, Yuxing

    2009-09-25

    The double-headed arrowhead protease inhibitors API-A and -B from the tubers of Sagittaria sagittifolia (Linn) feature two distinct reactive sites, unlike other members of their family. Although the two inhibitors have been extensively characterized, the identities of the two P1 residues in both API-A and -B remain controversial. The crystal structure of a ternary complex at 2.48 A resolution revealed that the two trypsins bind on opposite sides of API-A and are 34 A apart. The overall fold of API-A belongs to the beta-trefoil fold and resembles that of the soybean Kunitz-type trypsin inhibitors. The two P1 residues were unambiguously assigned as Leu(87) and Lys(145), and their identities were further confirmed by site-directed mutagenesis. Reactive site 1, composed of residues P5 Met(83) to P5' Ala(92), adopts a novel conformation with the Leu(87) completely embedded in the S1 pocket even though it is an unfavorable P1 residue for trypsin. Reactive site 2, consisting of residues P5 Cys(141) to P5' Glu(150), binds trypsin in the classic mode by employing a two-disulfide-bonded loop. Analysis of the two binding interfaces sheds light on atomic details of the inhibitor specificity and also promises potential improvements in enzyme activity by engineering of the reactive sites.

  19. Determination of stability constant of ternary surface complexes at liquid-solid interface in sea water by the rule of left-right shifts of S-shaped curve

    Institute of Scientific and Technical Information of China (English)

    张正斌; 刘莲生; 刘国盛; 俞志明

    1996-01-01

    A new method is suggested for determining the stability constant of ternary surface complexes (TSC) at liquid-solid interfaces in natural water. Its basic principle is based on the rule of left-right shift (RLRS) of S-shaped curve, from which the peak-type curve of E(%) with the concentration of organic matter is obtained. The peak-type curve is further used to obtain the (ksAM/kSM) values by using respectively the method of equality of E(%) when [H2A] = [H2A]0 (1) and the method of [H2A]max (2). From the known KSM,the stability constant KSAM of liquid-solid interfacial ternary surface complexes can be obtained.

  20. A europium(III) organic ternary complex applied in fabrication of near UV-based white light-emitting diodes

    Science.gov (United States)

    Wang, H.; He, P.; Liu, S.; Shi, J.; Gong, M.

    2009-10-01

    A β-diketone, 2-acetylfluorene-4,4,4-trifluorobutane-1,3-dione (HAFTFBD), and its three europium(III) complexes, Eu(AFTFBD)3ṡ2H2O, Eu(AFTFBD)3(TPPO)2 and Eu(AFTFBD)3phen, were designed and synthesized, where TPPO was triphenylphosphine oxide and phen was 1,10-phenanthroline. The complexes were characterized by IR, UV-visible, photoluminescence (PL) spectroscopy and thermogravimetric analysis (TGA). The results show that the Eu(III) complexes exhibit a high thermal stability,and wide and strong excitation bands when monitored at 613 nm. Excited by ˜395 nm near UV light, the complexes emitted strong and characteristic red light due to f- f transitions of the central Eu3+ ion, and no emission from the ligands was found. The photoluminescence mechanism of the europium(III) complexes was investigated and proposed as a ligand-sensitized luminescence process. Among the three europium(III) complexes, Eu(AFTFBD)3phen exhibits the highest thermal stability and the most excellent photoluminescence properties. A bright red light-emitting diode was fabricated by coating the Eu(AFTFBD)3phen complex onto an ˜395 nm-emitting InGaN chip, and the LED showed appropriate CIE chromaticity coordinates ( x=0.66, y=0.33). A white LED with CIE chromaticity coordinates ( x=0.32, y=0.32) was prepared with Eu(AFTFBD)3phen as red phosphor, indicating that Eu(AFTFBD)3phen can be applied as a red component for fabrication of near ultraviolet-based white light-emitting diodes.

  1. Synthesis, structure, theoretical studies and luminescent properties of a ternary erbium(III) complex with acetylacetone and bathophenanthroline ligands

    Energy Technology Data Exchange (ETDEWEB)

    Martín-Ramos, Pablo [CEMDRX, Department of Physics, Universidade de Coimbra, Rua Larga, P-3004-516 Coimbra (Portugal); Advanced Materials Laboratory, ETSIIAA, Universidad de Valladolid, Avenida de Madrid 44, 34004 Palencia (Spain); Silva, Pedro S. Pereira, E-mail: psidonio@pollux.fis.uc.pt [CEMDRX, Department of Physics, Universidade de Coimbra, Rua Larga, P-3004-516 Coimbra (Portugal); Chamorro-Posada, Pedro [Higher Technical School of Telecommunications Engineering, Universidad de Valladolid, Campus Miguel Delibes, Paseo Belén 15, 47011 Valladolid (Spain); Silva, Manuela Ramos [CEMDRX, Department of Physics, Universidade de Coimbra, Rua Larga, P-3004-516 Coimbra (Portugal); Milne, Bruce F. [Centre for Computational Physics, Department of Physics, Universidade de Coimbra, P-3004-516 Coimbra (Portugal); Donostia International Physics Centre, Paseo Manuel de Lardizabal 4, 20018 Donostia-San Sebastián (Spain); Nogueira, Fernando [Centre for Computational Physics, Department of Physics, Universidade de Coimbra, P-3004-516 Coimbra (Portugal); Martín-Gil, Jesús [Advanced Materials Laboratory, ETSIIAA, Universidad de Valladolid, Avenida de Madrid 44, 34004 Palencia (Spain)

    2015-06-15

    A novel erbium(III) complex with acetylacetone (Hacac) and bathophenanthroline (4,7-diphenyl-1,10-phenanthroline, bath) ligands, formulated as [Er(acac){sub 3}(bath)], has been characterized by elemental analysis, X-ray diffraction, thermogravimetric analysis, Fourier transform infrared spectroscopy, Raman spectroscopy, absorption and emission spectroscopies. In the theoretical part of this study, semi-empirical quantum chemistry methods using AM1, PM3, PM6 and PM7 models have been employed to predict the structure of the complex, calculate the geometric and crystallographic parameters, and make comparisons with spectroscopic data using INDO/S-CI calculations. Real-time time-dependent density-functional theory (TDDFT) has also been used to calculate the optical absorption spectrum of the complex in the gas phase. - Highlights: • Synthesis and structure of a new erbium(III) β-diketonate complex. • TDDFT used for the first time to calculate the optical absorption spectrum. • Complex show strong near-infrared luminescence at 1.53 µm due to antenna effect.

  2. A neutron scattering study of the ternary complex EF-Tu.GTP-valyl-tRNAVal1A

    DEFF Research Database (Denmark)

    Österberg, R.; Elias, P.; Kjems, Jørgen

    1986-01-01

    matched by the solvents. The results indicate that EF-Tu undergoes a conformational change and contracts as a result of the complex formation, since the radius of gyration decreases by 15% from 2.82 to 2.39 nm. tRNAVal1A, on the other hand, seems to mainly retain its conformation within the complex, since......The complex formation between elongation factor Tu (EF-Tu), GTP, and valyl-tRNAVal1A has been investigated in a hepes buffer of "pH" 7.4 and 0.2 M ionic strength using the small-angle neutron scattering method at concentrations of D2O where EF-Tu (42% D2O) and tRNA (71% D2O) are successively...

  3. Anticancer activity and computational modeling of ternary copper (II) complexes with 3-indolecarboxylic acid and 1,10-phenanthroline.

    Science.gov (United States)

    Zhang, Zhen; Wang, Huiyun; Wang, Qibao; Yan, Maocai; Wang, Huannan; Bi, Caifeng; Sun, Shanshan; Fan, Yuhua

    2016-08-01

    Metal-containing compounds have been extensively studied for many years as potent proteasome inhibitors. The 20S proteasome, the main component of the ubiquitin proteasome pathway, is one of the excellent targets in anticancer drug development. We recently reported that several copper complexes were able to inhibit cancer-special proteasome and induce cell death in human cancer cells. However, the involved molecular mechanism is not known yet. We therefore synthesized three copper complexes and investigated their abilities on inhibiting proteasome activity and inducting apoptosis in human breast cancer cells. Furthermore, we employed molecular dockings to analyze the possible interaction between the synthetic copper complexes and the β5 subunit of proteasome which only reflects the chymotrypsin-like activity. Our results demonstrate that three Cu(II) complexes possess potent proteasome inhibition capability in a dose-dependent and time-dependent manner in MDA-MB-231 human breast cancer cells. They could bind to the β5 subunit of the 20S proteasome, which consequently cause deactivation of the proteasome and tumor cell death. The present study is significant for providing important theoretical basis for design and synthesis of anticancer drugs with low toxicity, high efficiency and high selectivity.

  4. Crystallographic analysis of the ternary complex of octanoate and N-acetyl-l-methionine with human serum albumin reveals the mode of their stabilizing interactions.

    Science.gov (United States)

    Kawai, Akito; Chuang, Victor T G; Kouno, Yosuke; Yamasaki, Keishi; Miyamoto, Shuichi; Anraku, Makoto; Otagiri, Masaki

    2017-08-01

    During pasteurization and storage of albumin products, Sodium octanoate (Oct) and N-acethyl-l-tryptophan (N-AcTrp) are used as the thermal stabilizer and the antioxidant for human serum albumin (HSA), respectively. We recently reported that N-acethyl-l-methionine (N-AcMet) is an antioxidant for HSA, which is superior to N-AcTrp when it is especially exposed to light during storage. The objective of the present study is to clarify the molecular mechanism responsible for the HSA protective effect of Oct and N-AcMet based on their ternary complex structure. Crystal structure of the HSA-Oct-N-AcMet complex showed that one N-AcMet molecule is bound to the entrance of drug site 1 of HSA, and its side chain, which is susceptible to the oxidation, is exposed to the solvent. At the same time, two Oct binding sites are observed in drug sites 1 and 2 of HSA, respectively, and each Oct molecule occupies the hydrophobic cavity in them. These results indicate the molecular mechanism responsible for the HSA stabilization by these small molecules as follows. N-AcMet seals the entrance of drug site 1 while it acts as an antioxidant for HSA. Oct is chiefly bound to drug site 2 of HSA and it increases the thermal stability of HSA because of the occupying the largest intra-cavity of sub-domain IIIA in HSA. These findings suggest that N-AcMet acts positively as useful stabilizer for albumin formulated products such as functionalized HSA and HSA fusion proteins. Copyright © 2017 Elsevier B.V. All rights reserved.

  5. Crystallization and preliminary crystallographic data for a ternary complex between tissue factor, factor VIIa and a BPTI-derived inhibitor

    Science.gov (United States)

    Stura, Enrico A.; Ruf, Wolfram; Wilson, Ian A.

    1996-10-01

    The binding of tissue factor (TF) with the serine protease coagulation factor VIIa (VIIa) is the initial trigger for activation of the coagulation protease cascades. In complex with TF, VIIa has profoundly enhanced function in the limited proteolytic activation of the natural substrate factors X and IX. Here we report the screening and identification of crystallization conditions to produce diffraction quality crystals of the complex between TF · VIIa and a potent inhibitor (5L 15) derived from mutagenesis of the bovine pancreatic trypsin inhibitor (BPTI) sequence. The complex crystals were obtained from the soluble extracellular domain of tissue factor, expressed in Escherichia coli as a fusion protein, VIIa expressed in mammalian cells and recombinant 5L15. Because only 1.5 mg of complex were available for this work, a reverse screening based strategy was used in the search and optimization of the crystallization conditions. Two different crystal forms were obtained from polyethylene glycol 4000 and monomethyl polyethylene glycol 2000 with cacodylate buffer at pH 6.5 in the presence of sodium and calcium ions. The addition of magnesium and zinc have profound effects on the crystallization. Both crystal forms are trigonal with cell parameters a = b = 129.3 Å, c = 110.8 Å and a = b = 67.2 Å, c = 314.8 Å diffracting to 7 and 3.2 Å resolution, respectively, each with one molecule in the asymmetric unit. Complete data sets have been collected from each of these forms to the resolution to which the crystals diffract. A structural understanding of the interaction of VIIa with its cofactor TF to form a binary enzyme, and its inhibition by 5L15 will provide a basis for the development of antithrombotic strategies.

  6. Synthesis and characterization of binary and ternary complexes of Co(II), Ni(II), Cu(II) and Zn(II) ions based on 4-aminotoluene-3-sulfonic acid

    Science.gov (United States)

    Faheim, Abeer A.; Abdou, Safaa N.; Abd El-Wahab, Zeinab H.

    2013-03-01

    Salicylidene (4-aminotoluene-3-sulfonic acid) Schiff base ligand H2L, and its binary and ternary Co(II), Ni(II), Cu(II) and Zn(II) complexes using 8-hydroxyquinoline (8-HOqu) and 2-aminopyridine (2-Ampy) as secondary ligands have been synthesised and characterized via elemental analysis, spectral data (IR, 1H NMR, mass and solid reflectance), molar conductance, magnetic moment, TG-DSC measurements and XRPD analysis. Correlation of all spectroscopic data suggest that H2L ligand acts as monoanionic terdentate ligand with ONO sites coordinating to the metal ions via deprotonated phenolic-O, azomethine-N and sulfonate-O while 2-Ampy behaves as a neutral monodentate ligand via amino group-N and 8-HOqu behaves as a monoanionic bidentate ligand through the ring-N and deprotonated phenolic-O. The thermal behavior of these complexes shows that the coordinated water molecules were eliminated from the complexes at relatively higher temperatures than the hydrated water and there are two routes in removal of coordinated water molecules. All complexes have mononuclear structure and the tetrahedral, square planar or an octahedral geometry have been proposed. The ligand and its complexes have been screened for their antimicrobial activity against Staphylococcus aureus, Bacillus subtilis, Escherichia coli, Salmonella typhimurium, Candida albicans and Aspergillus fumigatus. Among the synthesised compounds, the binary and ternary Ni(II) complexes, (2, 8 and 10) and ternary Zn(II) complex, (12) were found to be very effective against Candida albicans and Bacillus subtilis than all other complexes with MICs of 2 and 8 μg/mL, respectively.

  7. A Novel Ternary Ligand System Useful for Preparation of Cationic 99mTc-Diazenido Complexes and 99mTc-Labeling of Small Biomolecules

    Science.gov (United States)

    Kim, Young-Seung; He, Zhengjie; Hsieh, Wen-Yuan; Liu, Shuang

    2008-01-01

    This report describes a novel ternary ligand system composed of a phenylhydrazine, a crown ether-containing dithiocarbamate (DTC) and a PNP-type bisphosphine (PNP). The combination of three different ligands with 99mTc results in cationic 99mTc-diazenido complexes,[99mTc(NNAr)(DTC)(PNP)]+, with potential radiopharmaceuticals for heart imaging. Synthesis of cationic 99mTc-diazenido complexes can be accomplished in two steps with high yield. For example, the reaction of phenylhydrazine with 99mTcO4− at 100 °C in the presence of excess stannous chloride and 1,2-diaminopropane-N,N,N’,N’-tetraacetic acid (PDTA) results in the [99mTc(NNPh)(PDTA)n] intermediate, which then reacts with sodium N-(dithiocarbamato)-2-aminimethyl-15-Crown-5 (L4) and N,N-bis[2-(bis(3-ethoxypropyl)phosphino)ethyl]ethoxy-ethylamine (PNP6) at 100 °C for 15 min to give the complex, [99mTc(NNPh)(L4)(PNP6)]+ in high yield (> 90%). Cationic complexes [99mTc(NNPh)(DTC)(PNP)]+ are stable for ≥6 h. Their composition was determined to be 1:1:1:1 for Tc:NNPh:DTC:PNP using the mixed-ligand experiments on the tracer (99mTc) level, and was further confirmed by the ESI-MS spectral data of a model compound [Re(NNPh)(L4)(L6)]+. It was found that both DTCs and bisphosphines have a significant impact on the lipophilicity of their cationic 99mTc-diazenido complexes. Results from a 99mTc-labeling efficiency experiment showed that 4-hydrazinobenzoic acid (HYBA) might be useful as a bifunctional coupling agent for 99mTc-labeling of small biomolecules. However, the 99mTc-labeling efficiency of HYBA is much lower than that of 6-hydrazinonicotinic acid (HYNIC) with tricine and trisodium triphenylphosphine-3,3’,3”-trisulfonate (TPPTS) as coligands. PMID:16536480

  8. Ternary complexes metal [Co(II), Ni(II), Cu(II) and Zn(II)]--ortho-iodohippurate (I-hip)--acyclovir. X-ray characterization of isostructural [(Co, Ni or Zn)(I-hip)(2)(ACV)(H(2)O)(3)] with stacking as a recognition factor.

    Science.gov (United States)

    Barceló-Oliver, M; Terrón, A; García-Raso, A; Fiol, J J; Molins, E; Miravitlles, C

    2004-11-01

    Four ternary metal--ortho-iodohippurate (I-hip)--acyclovir (ACV) complexes, [M(I-hip)(2)(ACV)(H(2)O)(3)] where M is Co(II) (1), Ni(II) (2), Cu (3) and Zn(II) have been obtained by reaction between the corresponding binary complexes M(II)(I-hip)(2)xnH(2)O and ACV. Three ternary complexes (M=Co, Ni and Zn) and the corresponding Zn(II)--ortho-iodohippurate binary derivative have been structurally characterized by X-ray diffraction: The studies show these three ternary complexes are isostructural and present, in solid state, an interesting stacking between the nucleobase and the aryl ring of the hippurate moiety, which probably promotes the formation of ternary complexes. Moreover, the two different ligands interact between them by means of ancillary hydrogen bonds with water molecules coordinated to the metal ion. It must be mentioned that these two recognition factors, hydrogen bonds plus stacking, could explain the reason for the isostructurality of these ternary derivatives with so different three metal ions, with diverses trends in coordination numbers and geometries. In solid state, there are two enantiomeric molecules that are related by an inversion center as the crystal-building unit (as a translational motif) for the ternary complexes.

  9. The acid-labile subunit of the ternary insulin-like growth factor complex in cirrhosis: relation to liver dysfunction

    DEFF Research Database (Denmark)

    Møller, S; Juul, A; Becker, U;

    2000-01-01

    BACKGROUND/AIMS: In the circulation, insulin-like growth factor-I (IGF-I) is bound in a trimeric complex of 150 kDa with IGF binding protein-3 (IGFBP-3) and the acid-labile subunit (ALS). Whereas circulating IGF-I and IGFBP-3 are reported to be low in patients with chronic liver failure, the level...... of ALS has not been described in relation to hepatic dysfunction. The aim of the present study was therefore to measure circulating and hepatic venous concentrations of ALS in relation to hepatic function and the IGF axis. METHODS: Twenty-five patients with cirrhosis (Child class A/B/C:5/10/10) and 30...... controls with normal liver function were studied. During a haemodynamic investigation, blood samples were collected from the hepatic vein and femoral artery, and the plasma concentrations of ALS, IGF-I and IGFBP-3 were determined. RESULTS: Hepatic venous and arterial concentrations of ALS were...

  10. Ca2+ dependence of the distance between Cys-98 of troponin C and Cys-133 of troponin I in the ternary troponin complex. Resonance energy transfer measurements.

    Science.gov (United States)

    Tao, T; Gowell, E; Strasburg, G M; Gergely, J; Leavis, P C

    1989-07-11

    We have used resonance energy transfer to study the spatial relationship between Cys-98 of rabbit skeletal troponin C and Cys-133 of rabbit skeletal troponin I in the reconstituted ternary troponin complex. The donor was introduced by labeling either troponin C or troponin I with N-(iodoacetyl)-N'-(5-sulfo-1-naphthyl)ethylenediamine, while the acceptor was introduced by labeling either protein with N-[4-(dimethylamino)phenyl-4'-azophenyl]maleimide. The extent of energy transfer was determined by measuring the quenching of the donor fluorescence decay. The results indicate first that the distance between these two sites is not fixed, suggesting that the protein regions involved possess considerable segmental flexibility. Second, the mean distance between the two sites is dependent on the metal-binding state of troponin C, being 39.1 A when none of the metal-binding sites are occupied, 41.0 A when Mg2+ ions bind at the high-affinity sites, and 35.5 A when Ca2+ ions bind to the low-affinity sites. Neither the magnitude of the distances nor the trend of change with metal ions differs greatly when the locations of the probes are switched or when steady-state fluorometry was used to determine the transfer efficiency. Since the low-affinity sites have been implicated as the physiological triggering sites, our findings suggest that one of the key events in Ca2+ activation of skeletal muscle contraction is a approximately 5-A decrease in the distance between the Cys-98 region of troponin C and the Cys-133 region of troponin I.

  11. Analysis of the cloverleaf element in a human rhinovirus type 14/poliovirus chimera: correlation of subdomain D structure, ternary protein complex formation and virus replication.

    Science.gov (United States)

    Rieder, Elizabeth; Xiang, Wenkai; Paul, Aniko; Wimmer, Eckard

    2003-08-01

    RNA genomes of enteroviruses and rhinoviruses contain a 5'-terminal structure, the cloverleaf (CL), which serves as signal in RNA synthesis. Substitution of the poliovirus [PV1(M)] CL with that of human rhinovirus type 2 (HRV2) was shown previously to produce a viable chimeric PV, whereas substitution with the HRV14 CL produced a null phenotype. Fittingly, the HRV14 CL failed to form a complex with PV-specific proteins 3CD(pro)-3AB or 3CD(pro)-PCBP2, considered essential for RNA synthesis. It was reported previously (Rohll et al., J Virol 68, 4384-4391, 1994) that the major determinant for the null phenotype of a PV/HRV14 chimera resides in subdomain Id of the HRV14 CL. Using a chimeric PV/HRV14 CL in the context of the PV genome, stem-loop Id of HRV14 CL was genetically dissected. It contains the sequence C(57)UAU(60)-G, the underlined nucleotides forming the loop that is shorter by 1 nt when compared to the corresponding PV structure (UUGC(60)GG). Insertion of a G nucleotide to form a tetra loop (C(57)UAU(60)GG(61)) did not rescue replication of the chimera. However, an additional mutation at position 60 (C(57)UAC(60)GG(61)) yielded a replicating genome. Only the mutant PV/HRV14 CL with the UAC(60)G tetra loop formed ternary complexes efficiently with either PV proteins 3CD(pro)-3AB or 3CD(pro)-PCBP2. Thus, in the context of PV RNA synthesis, the presence of a tetra loop in subdomain D of the CL per se is not sufficient for function. The sequence and, consequently, the structure of the tetra loop plays an essential role. Biochemical assays demonstrated that the function of the CL element and the function of the cis-acting replication element in the 3D(pol)-3CD(pro)-dependent uridylylation of VPg are not linked.

  12. Ternary chalcopyrite semiconductors

    CERN Document Server

    Shay, J L; Pamplin, B R

    2013-01-01

    Ternary Chalcopyrite Semiconductors: Growth, Electronic Properties, and Applications covers the developments of work in the I-III-VI2 and II-IV-V2 ternary chalcopyrite compounds. This book is composed of eight chapters that focus on the crystal growth, characterization, and applications of these compounds to optical communications systems. After briefly dealing with the status of ternary chalcopyrite compounds, this book goes on describing the crystal growth of II-IV-V2 and I-III-VI2 single crystals. Chapters 3 and 4 examine the energy band structure of these semiconductor compounds, illustrat

  13. Balanced ternary addition using a gated silicon nanowire

    NARCIS (Netherlands)

    Mol, J.A.; Van der Heijden, J.; Verduijn, J.; Klein, M.; Remacle, F.; Rogge, S.

    2011-01-01

    Ternary logic has the lowest cost of complexity, here, we demonstrate a CMOS hardware implementation of a ternary adder using a silicon metal-on-insulator single electron transistor. Gate dependent rectifying behavior of a single electron transistor (SET) results in a robust three-valued output as a

  14. Synthesis and Photoluminescence Properties of New Europium, Terbium (Ⅲ)Ternary Complexes Based on β-diketone%新的稀土Eu,Tb(Ⅲ)β-二酮三元配合物的合成与光谱性质

    Institute of Scientific and Technical Information of China (English)

    程果; 魏长平; 任晓明; 王贺

    2012-01-01

    The β-diketone l-(4-aminophenyl)-3-phe-nylpropane-1,3-dione(L) was synthesized by classical Claisen condensation reaction, and the composition of the (3-diketone L was confirmed by elemental analysis and 1H NMR spectra. The result of 1H NMR spectra indicated that the ligand L existed as an enol form iso-mer, which was consistent with the result of IR analysis. With L as the first ligand and 1 ,10-phenanthro-line (phen) or 2 ,2'-bipyridin (bipy) as the secondary ligand, four new rare-earth Eu, Tb ( IH ) ternary complexes were prepared in ethanol solution. The ligand L and ternary complexes were characterized by elemental analysis, 1H NMR spectra, IR spectra, UV-vis spectra, phosphorescence spectra and fluorescence spectra. IR spectra indicated that; the rare-earth ion in the ternary complexes was coordinated with six oxygen atoms of three L ligands and two nitrogen atoms ofthe second ligand. The UV-vis spectra showed that the main absorption was from the ligand L in the ternary complexes. The fluorescence spectra demonstrated that the complexes could emit characteristic fluorescence of rare-earth ion and the strongest emission band was narrow which was attributed to the transitions of the 4f electrons of the central ions. The fluorescence intensity of Tb ( III ) ternary complexes was obviously higher than that of Eu ( HI ) ternary complexes, and this indicated that the energy level difference between the triplet state of ligand L and the emission energy of Tb3+ was well matched. The fluorescence spectra also showed that the phen was a better secondary ligand than bipy. So, the Tb(L)3phen exhibited the highest emission than others. It is an excellent green-emitter which would be regarded as a valuable material with bright green fluorescence.%采用Claisen缩合反应合成了一种β-二酮1-(4-氨基苯)-3-苯基丙烷-1,3-二酮(L:C15H13NO2),以元素分析和1H NMR谱确定了其组成,核磁和红外分析结果表明L主要以烯醇式存在.以L为第一

  15. Differentiating phosphates by an Mg(2+) complex of the conjugate of calix[4]arene via the formation of ternary species and causing changes in the aggregation: spectroscopy, microscopy, and computational modeling.

    Science.gov (United States)

    Nehra, Anita; Yarramala, Deepthi S; Hinge, Vijaya Kumar; Samanta, Kushal; Rao, Chebrolu Pulla

    2015-09-15

    A phenylene diimine capped conjugate of 1,3-calix[4]arene (L) was synthesized and characterized, and its Mg(2+) complex has been isolated and characterized. The chemo sensing ensemble of Mg(2+) bound L provides distinguishable features of response toward phosphates, viz., HPO4(2-), P2O7(4-), and AMP(2-) (Set A) and H2PO4(-), ATP(2-), and ADP(2-) (Set B). While the Set A shows the formation of ternary complex, the Set B does not exhibit any intermediate complex, but both show the release of Mg(2+) and L at different equivalents. The structures of {L + Mg(2+)} and its phosphate bound ternary complexes have been established by computational calculations, and the corresponding results agree well with the experimental ones. The microscopy studies show an aggregation-disaggregation phenomenon in the presence of different equivalents of phosphates in both of the sets. Using the fluorescence data, an INHIBIT logic gate has been built.

  16. Ternary optical computer principle

    Institute of Scientific and Technical Information of China (English)

    金翊; 何华灿; 吕养天

    2003-01-01

    The fundamental principle and the characteristics of ternary optical computer, using horizontal polarized light, vertical polarized light and no-intensity to express information, are propounded in thispaper. The practicability to make key parts of the ternary optical computer from modern micro or integrated optical devices, opto-electronic and electro-photonic elements is discussed. The principle can be applied in three-state optical fiber communication via horizontal and vertical polarized light.

  17. The ligand-receptor-G-protein ternary complex as a GTP-synthase. steady-state proton pumping and dose-response relationships for beta -adrenoceptors.

    Science.gov (United States)

    Broadley, K J; Nederkoorn, P H; Timmerman, H; Timms, D; Davies, R H

    2000-07-21

    Steady-state solutions are developed for the rate of G alpha.GTP production in a synthase model of the ligand-receptor-G-protein ternary complex activated by a ligand-receptor proton pumping mechanism. The effective rate, k(31), defining the proton transfer, phosphorylation and G alpha.GTP release is a controlling rate of the synthase in the presence of a ligand with an efficient mode of signal activation, the ligand-receptor interaction taking place under effectively equilibrium conditions. The composite rate, however, becomes an amplifying factor in any dose-response relationship. The amplification is a triple product of the rate, k(31), the equilibrium constant associated with the activation of the proton signal, K(act)and the fraction of agonist conformer transmitting the signal, f(*). Where the rate of activation of the proton signal becomes critically inefficient, the rate of activation, k(act 1)replaces k(31)K(act). A correlation between beta(1)-adrenergic receptor-stimulated GDP release and adenylate cyclase activation shows that this correlation is not unique to an exchange reaction. Within the initiating Tyr-Arg-Tyr receptor proton shuttle mechanism, the position of Arg(r156) paralleldictates the high-(R(p)) and low-(R(u)) ligand-binding affinities. These states are close to R(*)and R(0)of the equilibrium model (De Lean et al., 1980, J. Biol. Chem.255, 7108-7117). An increased rate of hydrogen ion diffusion into a receptor mutant can give rise to constitutive activity while increased rates of G-protein release and changes in receptor state balance can contribute to the resultant level of action. Constitutive action will arise from a faster rate of G-protein release alone if proton diffusion in the wild-type receptor contributes to a basal level of G-protein activation. Competitive ligand-receptor occupancy for constitutive mutants shows that, where the rate of G-protein activation from the proportion of ligand-occupied receptors is less than the

  18. Organic ternary solar cells: a review.

    Science.gov (United States)

    Ameri, Tayebeh; Khoram, Parisa; Min, Jie; Brabec, Christoph J

    2013-08-21

    Recently, researchers have paid a great deal of attention to the research and development of organic solar cells, leading to a breakthrough of over 10% power conversion efficiency. Though impressive, further development is required to ensure a bright industrial future for organic photovoltaics. Relatively narrow spectral overlap of organic polymer absorption bands within the solar spectrum is one of the major limitations of organic solar cells. Among different strategies that are in progress to tackle this restriction, the novel concept of ternary organic solar cells is a promising candidate to extend the absorption spectra of large bandgap polymers to the near IR region and to enhance light harvesting in single bulk-heterojunction solar cells. In this contribution, we review the recent developments in organic ternary solar cell research based on various types of sensitizers. In addition, the aspects of miscibility, morphology complexity, charge transfer dynamics as well as carrier transport in ternary organic composites are addressed.

  19. True ternary fission

    Science.gov (United States)

    Vijayaraghavan, K. R.; Balasubramaniam, M.; von Oertzen, W.

    2015-04-01

    The study of the ternary fission of nuclei has received new interest recently. It is of general interest for nuclear dynamics, although the process is very rare. In the present work, we discuss the possibilities of true ternary fission (fragment masses A >30 ) in 252Cf for different mass splits. These mass splits are strongly favored in a collinear geometry. Based on the three cluster model (TCM), it is shown that the true ternary fission into fragments with almost equal masses is one of the possible fission modes in 252Cf . For general decays it is shown that the formation of the lightest fragment at the center has the highest probability. Further the formation of tin isotopes and/or other closed shell fragments are favored. For the decay products the presence of closed shell nuclei among the three fragments enhances the decay probabilities.

  20. 苯甲酸铜三元配合物的谱学研究与成键特征%Study on the synthesis and spectrum of copper(Ⅱ) benzoate ternary complex

    Institute of Scientific and Technical Information of China (English)

    田俐; 陈琳

    2001-01-01

    对苯甲酸铜三元配合物单晶[Cu(ba)2(phen)(H2O)]2(ba表示苯甲酸根阴离子;phen 表示1,10-邻菲咯啉)进行了红外光谱和电子吸收光谱研究,探讨了配位中心铜(Ⅱ)离子的成键特征.%In this paper, the copper(Ⅱ) benzoate ternary complex [Cu(ba)2(phen)(H2O)]2(where ba=benzoic acid and phen=1,10-phenanthroline has been synthesized. It was studied by IR and UV-VIS spectrum which indicates that Cu(Ⅱ)ion is five coordinated in the complex.

  1. PDZ domain-containing 1 (PDZK1) protein regulates phospholipase C-β3 (PLC-β3)-specific activation of somatostatin by forming a ternary complex with PLC-β3 and somatostatin receptors.

    Science.gov (United States)

    Kim, Jung Kuk; Kwon, Ohman; Kim, Jinho; Kim, Eung-Kyun; Park, Hye Kyung; Lee, Ji Eun; Kim, Kyung Lock; Choi, Jung Woong; Lim, Seyoung; Seok, Heon; Lee-Kwon, Whaseon; Choi, Jang Hyun; Kang, Byoung Heon; Kim, Sanguk; Ryu, Sung Ho; Suh, Pann-Ghill

    2012-06-15

    Phospholipase C-β (PLC-β) is a key molecule in G protein-coupled receptor (GPCR)-mediated signaling. Many studies have shown that the four PLC-β subtypes have different physiological functions despite their similar structures. Because the PLC-β subtypes possess different PDZ-binding motifs, they have the potential to interact with different PDZ proteins. In this study, we identified PDZ domain-containing 1 (PDZK1) as a PDZ protein that specifically interacts with PLC-β3. To elucidate the functional roles of PDZK1, we next screened for potential interacting proteins of PDZK1 and identified the somatostatin receptors (SSTRs) as another protein that interacts with PDZK1. Through these interactions, PDZK1 assembles as a ternary complex with PLC-β3 and SSTRs. Interestingly, the expression of PDZK1 and PLC-β3, but not PLC-β1, markedly potentiated SST-induced PLC activation. However, disruption of the ternary complex inhibited SST-induced PLC activation, which suggests that PDZK1-mediated complex formation is required for the specific activation of PLC-β3 by SST. Consistent with this observation, the knockdown of PDZK1 or PLC-β3, but not that of PLC-β1, significantly inhibited SST-induced intracellular Ca(2+) mobilization, which further attenuated subsequent ERK1/2 phosphorylation. Taken together, our results strongly suggest that the formation of a complex between SSTRs, PDZK1, and PLC-β3 is essential for the specific activation of PLC-β3 and the subsequent physiologic responses by SST.

  2. PDZ Domain-containing 1 (PDZK1) Protein Regulates Phospholipase C-β3 (PLC-β3)-specific Activation of Somatostatin by Forming a Ternary Complex with PLC-β3 and Somatostatin Receptors*

    Science.gov (United States)

    Kim, Jung Kuk; Kwon, Ohman; Kim, Jinho; Kim, Eung-Kyun; Park, Hye Kyung; Lee, Ji Eun; Kim, Kyung Lock; Choi, Jung Woong; Lim, Seyoung; Seok, Heon; Lee-Kwon, Whaseon; Choi, Jang Hyun; Kang, Byoung Heon; Kim, Sanguk; Ryu, Sung Ho; Suh, Pann-Ghill

    2012-01-01

    Phospholipase C-β (PLC-β) is a key molecule in G protein-coupled receptor (GPCR)-mediated signaling. Many studies have shown that the four PLC-β subtypes have different physiological functions despite their similar structures. Because the PLC-β subtypes possess different PDZ-binding motifs, they have the potential to interact with different PDZ proteins. In this study, we identified PDZ domain-containing 1 (PDZK1) as a PDZ protein that specifically interacts with PLC-β3. To elucidate the functional roles of PDZK1, we next screened for potential interacting proteins of PDZK1 and identified the somatostatin receptors (SSTRs) as another protein that interacts with PDZK1. Through these interactions, PDZK1 assembles as a ternary complex with PLC-β3 and SSTRs. Interestingly, the expression of PDZK1 and PLC-β3, but not PLC-β1, markedly potentiated SST-induced PLC activation. However, disruption of the ternary complex inhibited SST-induced PLC activation, which suggests that PDZK1-mediated complex formation is required for the specific activation of PLC-β3 by SST. Consistent with this observation, the knockdown of PDZK1 or PLC-β3, but not that of PLC-β1, significantly inhibited SST-induced intracellular Ca2+ mobilization, which further attenuated subsequent ERK1/2 phosphorylation. Taken together, our results strongly suggest that the formation of a complex between SSTRs, PDZK1, and PLC-β3 is essential for the specific activation of PLC-β3 and the subsequent physiologic responses by SST. PMID:22528496

  3. Ternary fission of superheavy elements

    Science.gov (United States)

    Balasubramaniam, M.; Vijayaraghavan, K. R.; Manimaran, K.

    2016-01-01

    Ternary fission of superheavy nuclei is studied within the three-cluster model potential energy surfaces (PESs). Due to shell effects, the stability of superheavy nuclei has been predicted to be associated with Z =114 , 120, and 126 for protons and N =184 for neutrons. Taking some representative nuclei we have extended the ternary fission studies to superheavy nuclei. We adopted two minimization procedures to minimize the potential and considered different arrangements of the fragments. The PES from one-dimensional minimization reveals a strong cluster region favoring various ternary breakups for an arrangement in which the lightest fragment is kept at the center. The PES obtained from two-dimensional minimization reveals strong preference of ternary fragmentation in the true ternary fission region. Though the dominant decay mode of superheavy nuclei is α decay, the α -accompanied ternary breakup is found to be a nonfavorable one. Further, the prominent ternary combinations are found to be associated with the neutron magic number.

  4. 2.0A resolution crystal structures of the ternary complexes of human phenylalanine hydroxylase catalytic domain with tetrahydrobiopterin and 3-(2-thienyl)-L-alanine or L-norleucine: substrate specificity and molecular motions related to substrate binding.

    Science.gov (United States)

    Andersen, Ole Andreas; Stokka, Anne J; Flatmark, Torgeir; Hough, Edward

    2003-10-31

    The crystal structures of the catalytic domain of human phenylalanine hydroxylase (hPheOH) in complex with the physiological cofactor 6(R)-L-erythro-5,6,7,8-tetrahydrobiopterin (BH(4)) and the substrate analogues 3-(2-thienyl)-L-alanine (THA) or L-norleucine (NLE) have been determined at 2.0A resolution. The ternary THA complex confirms a previous 2.5A structure, and the ternary NLE complex shows that similar large conformational changes occur on binding of NLE as those observed for THA. Both structures demonstrate that substrate binding triggers structural changes throughout the entire protomer, including the displacement of Tyr138 from a surface position to a buried position at the active site, with a maximum displacement of 20.7A for its hydroxyl group. Two hinge-bending regions, centred at Leu197 and Asn223, act in consort upon substrate binding to create further large structural changes for parts of the C terminus. Thus, THA/L-Phe binding to the active site is likely to represent the epicentre of the global conformational changes observed in the full-length tetrameric enzyme. The carboxyl and amino groups of THA and NLE are positioned identically in the two structures, supporting the conclusion that these groups are of key importance in substrate binding, thus explaining the broad non-physiological substrate specificity observed for artificially activated forms of the enzyme. However, the specific activity with NLE as the substrate was only about 5% of that with THA, which is explained by the different affinities of binding and different catalytic turnover.

  5. Enantiomeric in vitro DNA binding, pBR322 DNA cleavage and molecular docking studies of chiral L- and D-ternary copper(II) complexes of histidine and picolinic acid.

    Science.gov (United States)

    Parveen, Shazia; Arjmand, Farukh; Ahmad, Iqbal

    2014-01-05

    Novel chiral ternary Cu(II) and Ni(II) complexes of l/d-histidine and picolinic acid, 1 and 2(a and b) were synthesized and characterized by elemental analysis, molar conductance and spectroscopic data (IR, NMR, EPR, UV-vis). In vitro DNA binding profile of both Cu(II) and Ni(II) complexes have been investigated by UV-vis titrations, while fluorescence spectroscopy, circular dichroism and viscosity measurements were carried out for Cu(II) complexes 1(a and b). Both the enantiomers of 1 and 2(a and b) bind to CT DNA via electrostatic interactions and the intrinsic binding constant, Kb values for complexes 1 and 2(a and b) were found to be 5.6×10(4), 9.8×10(3), 8.2×10(3) and 6.7×10(3)M(-1), respectively suggesting greater binding propensity of l-form of Cu(II) complex 1a. The DNA cleavage activity of complexes 1(a and b), investigated by agarose gel electrophoresis suggested an oxidative pathway for DNA cleavage. Further, the molecular docking studies of complexes 1(a and b) were carried out with B-DNA revealing that the complexes bind to the adenine-thymine residues in the minor groove of the DNA. The resulting binding energies of docked metal complexes 1(a and b) were found to be -265.1 and -218.9KJmol(-1), respectively. Furthermore, enantiomeric complexes 1 and 2(a and b) were screened for in vitro antimicrobial activity.

  6. Binary and ternary copper(II) complexes of a new Schiff base ligand derived from 4-acetyl-5,6-diphenyl-3(2H)-pyridazinone: Synthesis, spectral, thermal, antimicrobial and antitumor studies

    Science.gov (United States)

    Shebl, Magdy; Adly, Omima M. I.; Abdelrhman, Ebtesam M.; El-Shetary, B. A.

    2017-10-01

    A new Schiff base ligand was synthesized by the reaction of 4-acetyl-5,6-diphenyl-3(2H)-pyridazinone with ethylenediamine. A series of binary copper(II) Schiff base complexes have been synthesized by using various copper(II) salts; AcO-, NO3-, ClO4-, Cl- and Br-. Ternary complexes were synthesized by using auxiliary ligands (L‧) [N,O-donor; 8-hydroxyquinoline and glycine or N,N-donor; 1,10-phenanthroline, bipyridyl and 2-aminopyridine]. The structures of the Schiff base and its complexes were characterized by elemental and thermal analyses, IR, electronic, mass, 1H NMR and ESR spectra in addition to conductivity and magnetic susceptibility measurements. The obtained complexes include neutral binuclear complexes as well as neutral and cationic mononuclear complexes according to the anion used and the experimental conditions. The ESR spin Hamiltonian parameters of some complexes were calculated and discussed. The metal complexes exhibited octahedral and square planar geometrical arrangements depending on the nature of the anion. Kinetic parameters (Ea, A, ΔH, ΔS and ΔG) of the thermal decomposition stages were evaluated using Coats-Redfern equations. The antimicrobial activity of the Schiff base and its complexes was screened against Gram-positive bacteria (Staphylococcus aureus and Bacillus subtilis), Gram-negative bacteria (Salmonella typhimurium and Escherichia coli), yeast (Candida albicans) and fungus (Aspergillus fumigatus). The antitumor activity of the Schiff base and some of its Cu(II) complexes was investigated against HepG-2 cell line.

  7. Formation, stability and structural characterization of ternary MgUO{sub 2}(CO{sub 3}){sub 3}{sup 2-} and Mg{sub 2}UO{sub 2}(CO{sub 3}){sub 3}(aq) complexes

    Energy Technology Data Exchange (ETDEWEB)

    Lee, Jun-Yeop; Yun, Jong-Il [KAIST, Daejeon (Korea, Republic of). Dept. of Nuclear and Quantum Engineering; Vespa, Marika; Gaona, Xavier; Dardenne, Kathy; Rothe, Joerg; Rabung, Thomas; Altmaier, Marcus [Karlsruhe Institute of Technology, Karlsruhe (Germany). Inst. for Nuclear Waste Disposal

    2017-06-01

    The formation of ternary Mg-UO{sub 2}-CO{sub 3} complexes under weakly alkaline pH conditions was investigated by time-resolved laser fluorescence spectroscopy (TRLFS) and extended X-ray absorption fine structure (EXAFS) and compared to Ca-UO{sub 2}-CO{sub 3} complexes. The presence of two different Mg-UO{sub 2}-C{sub 3} complexes was identified by means of two distinct fluorescence lifetimes of 17±2 ns and 51±2 ns derived from the multi-exponential decay of the fluorescence signal. Slope analysis in terms of fluorescence intensity coupled with fluorescence intensity factor as a function of log [Mg(II)] was conducted for the identification of the Mg-UO{sub 2}-CO{sub 3} complexes forming. For the first time, the formation of both MgUO{sub 2}(CO{sub 3}){sub 3}{sup 2-} and Mg{sub 2}UO{sub 2}(CO{sub 3}){sub 3}(aq) species was confirmed and the corresponding equilibrium constants were determined as log β {sub 113}=25.8±0.3 and β {sub 213}=27.1±0.6, respectively. Complementarily, fundamental structural information for both Ca-UO{sub 2}-CO{sub 3} and Mg-UO{sub 2}-CO{sub 3} complexes was gained by extended EXAFS revealing very similar structures between these two species, except for the clearly shorter U-Mg distance (3.83 Aa) compared with U-Ca distance (4.15 Aa). These results confirmed the inner-sphere character of the Ca/Mg-UO{sub 2}-CO{sub 3} complexes. The formation constants determined for MgUO{sub 2}(CO{sub 3}){sub 3}{sup 2-} and Mg{sub 2}UO{sub 2}(CO{sub 3}){sub 3}(aq) species indicate that ternary Mg-UO{sub 2}-CO{sub 3} complexes contribute to the relevant uranium species in carbonate saturated solutions under neutral to weakly alkaline pH conditions in the presence of Mg(II) ions, which will induce notable influences on the U(VI) chemical species under seawater conditions.

  8. Synthesis, characterization and fungicidal activity of binary and ternary metal(II) complexes derived from 4,4‧-((4-nitro-1,2-phenylene) bis(azanylylidene))bis(3-(hydroxyimino)pentan-2-one)

    Science.gov (United States)

    El-Tabl, Abdou S.; Shakdofa, Mohamad M. E.; Whaba, Mohamad A.

    2015-02-01

    Ternary copper(II) and binary copper(II), nickel(II) and cobalt(II) complexes derived from 4,4‧-((4-nitro-1,2-phenylene)bis(azanylylidene))bis(3-(hydroxyimino)pentan-2-one) (H2L) were synthesized and characterized by elemental and thermal analyses, IR, UV-Vis. and 1H NMR spectroscopy, conductivity and magnetic moments measurements. The analytical and spectral data showed that, the ligand acts as dibasic tetradentate or dibasic hexadentate bonding to the metal ion via the two-imine nitrogen, two nitrogen and/or oximato oxygen atoms of deprotonated oxime groups forming five and/or six rings including the metal ions. The complexes adopt either tetragonal distorted octahedral or square planar geometry around metal ions. The ESR spectra of the solid copper(II) complexes are characteristic to d9 configuration and having an axial symmetry type of a d(x2-y2) ground state. The g values confirmed the geometry is elongated tetragonal octahedral geometry with considerably ionic or covalent environment. The antifungal biological activity of the prepared compounds was studied using well diffusion method. The obtained results showed that, the ligand is biologically inactive while its metal complexes were more potent fungicides than the ligand and standard antifungal drug (Amphotericin B).

  9. Improved Ternary Subdivision Interpolation Scheme

    Institute of Scientific and Technical Information of China (English)

    WANG Huawei; QIN Kaihuai

    2005-01-01

    An improved ternary subdivision interpolation scheme was developed for computer graphics applications that can manipulate open control polygons unlike the previous ternary scheme, with the resulting curve proved to be still C2-continuous. Parameterizations of the limit curve near the two endpoints are given with expressions for the boundary derivatives. The split joint problem is handled with the interpolating ternary subdivision scheme. The improved scheme can be used for modeling interpolation curves in computer aided geometric design systems, and provides a method for joining two limit curves of interpolating ternary subdivisions.

  10. NIR-luminescence from ternary lanthanide [Ho{sup III}, Pr{sup III} and Tm{sup III}] complexes with 1-(2-naphthyl)-4,4,4-trifluoro-1,3-butanedionate

    Energy Technology Data Exchange (ETDEWEB)

    Dang Song [State Key Laboratory of Rare Earth Chemistry and Physics, Changchun Institute of Applied Chemistry, Chinese Academy of Sciences, Changchun 130022 (China); Graduate School of the Chinese Academy of Sciences, Beijing (China); Yu Jiangbo [State Key Laboratory of Rare Earth Chemistry and Physics, Changchun Institute of Applied Chemistry, Chinese Academy of Sciences, Changchun 130022 (China); Wang Xiaofei [State Key Laboratory of Rare Earth Chemistry and Physics, Changchun Institute of Applied Chemistry, Chinese Academy of Sciences, Changchun 130022 (China); Graduate School of the Chinese Academy of Sciences, Beijing (China); Sun Lining [Research Center of Nano Science and Technology, Shanghai University, Shanghai 200444 (China); Deng Ruiping; Feng Jing [State Key Laboratory of Rare Earth Chemistry and Physics, Changchun Institute of Applied Chemistry, Chinese Academy of Sciences, Changchun 130022 (China); Fan Weiqiang [State Key Laboratory of Rare Earth Chemistry and Physics, Changchun Institute of Applied Chemistry, Chinese Academy of Sciences, Changchun 130022 (China); Graduate School of the Chinese Academy of Sciences, Beijing (China); Zhang Hongjie, E-mail: hongjie@ciac.jl.cn [State Key Laboratory of Rare Earth Chemistry and Physics, Changchun Institute of Applied Chemistry, Chinese Academy of Sciences, Changchun 130022 (China)

    2011-09-15

    The ligand 1-(2-naphthyl)-4,4,4-trifluoro-1,3-butanedionate (Htfnd) has been employed to synthesize six novel ternary-lanthanide complexes in which the synergic ligands were 1,10-phenanthroline-5,6-dione (dione) and 4,5-diazafluoren-9-one (dafone), respectively. Two series of complexes Ln(tfnd){sub 3}dione and Ln(tfnd){sub 3}dafone (Ln=Ho, Pr, Tm) were obtained. These complexes were characterized by elemental analysis, Fourier Transform Infrared spectra and diffused reflectance. After ligand-mediated excitation, Ln(tfnd){sub 3}dione and Ln(tfnd){sub 3}dafone all show the characteristic NIR luminescence of the corresponding Ln{sup 3+} ions (Ln=Ho, Pr, Tm). This can be attributed to the efficient energy transfer from ligands to central Ln{sup 3+} ions, via an antenna effect. The indirect energy transfer in the complexes has been investigated and the differences in the luminescence intensity between Ln(tfnd){sub 3}dione and Ln(tfnd){sub 3}dafone were discussed in detail. The excellent luminescent performances enable these NIR-luminescent complexes to have potential applications in optical amplification operating at 1300 or 1500 nm. - Highlights: > We study on Ln(tfnd){sub 3}dione and Ln(tfnd){sub 3}dafone complexes (Ln=Ho, Pr, Tm) based on different synergistic ligands. > Characteristic NIR luminescence of complexes has been obtained upon excitation of the ligand absorption bands. > Differences in the luminescence intensity of complexes were further discussed. > Dione ligand with lower triplet-state energy level than that of Htfnd discourage the luminescence of Ln(tfnd){sub 3}dione.

  11. Contributions of tryptophan 24 and glutamate 30 to binding long-lived water molecules in the ternary complex of human dihydrofolate reductase with methotrexate and NADPH studied by site-directed mutagenesis and nuclear magnetic resonance spectroscopy.

    Science.gov (United States)

    Meiering, E M; Li, H; Delcamp, T J; Freisheim, J H; Wagner, G

    1995-03-24

    Previous NMR studies on the ternary complex of human dihydrofolate reductase (hDHFR) with methotrexate (MTX) and NADPH detected six long-lived bound water molecules. Two of the water molecules, WatA and WatB, stabilize the structure of the protein while the other four, WatC, WatD, WatE and WatF, are involved in substrate binding and specificity. WatE may also act as a proton shuttle during catalysis. Here, the contributions of individual residues to the binding of these water molecules are investigated by performing NMR experiments on ternary complexes of mutant enzymes, W24F, E30A and E30Q. W24 and E30 are conserved residues that form hydrogen bonds with WatE in crystal structures of DHFR. Nuclear Overhauser effects (NOEs) are detected between WatE and the protein in all the mutant complexes, hence WatE still has a long lifetime bound to the complex when one of its hydrogen-bonding partners is deleted or altered by mutagenesis. The NOEs for WatE are much weaker, however, in the mutants than in wild-type. The NOEs for the other water molecules in and near the active site, WatA, WatC, WatD and WatF, also tend to be weaker in the mutant complexes. Little or no change is apparent in the NOEs for WatB, which is located outside the active site, farthest from the mutated residues. The decreased NOE intensities for the bound water molecules could be caused by changes in the positions and/or lifetimes of the water molecules. Chemical shift and NOE data indicate that the mutants have structures very similar to that of wild-type hDHFR, with possible conformational changes occurring only near the mutated residues. Based on the lack of structural change in the protein and evidence for increased structural fluctuations in the active sites of the mutant enzymes, it is likely that the NOE changes are caused, at least in part, by decreases in the lifetimes of the bound water molecules.

  12. Synthesis, investigation and spectroscopic characterization of piroxicam ternary complexes of Fe(II), Fe(III), Co(II), Ni(II), Cu(II) and Zn(II) with glycine and DL-phenylalanine

    Science.gov (United States)

    Mohamed, Gehad G.; El-Gamel, Nadia E. A.

    2004-11-01

    The ternary piroxicam (Pir; 4-hydroxy-2-methyl- N-(2-pyridyl)-2H-1,2-benzothiazine-3-carboxamide 1,1-dioxide) complexes of Fe(II), Fe(III), Co(II), Ni(II), Cu(II) and Zn(II) with various amino acids (AA) such as glycine (Gly) or DL-phenylalanine (PhA) were prepared and characterized by elemental analyses, molar conductance, IR, UV-Vis, magnetic moment, diffuse reflectance and X-ray powder diffraction. The UV-Vis spectra of Pir and the effect of metal chelation on the different interligand transitions are discussed in detailed manner. IR and UV-Vis spectra confirm that Pir behaves as a neutral bidentate ligand coordinated to the metal ions via the pyridine- N and carbonyl group of the amide moiety. Gly molecule acted as a uninegatively monodentate ligand and coordinate to the metal ions through its carboxylic group, in addition PhA acted as a uninegatively bidentate ligand and coordinate to the metal ions through its carboxylic and amino groups. All the chelates have octahedral geometrical structures while Cu(II)- and Zn(II)-ternary chelates with PhA have square planar geometrical structures. The molar conductance data reveal that most of these chelates are non electrolytes, while Fe(III)-Pir-Gly, Co(II)-, Ni(II)-, Cu(II)- and Zn(II)-Pir-PhA cheletes were 1:1 electrolytes. X-ray powder diffraction is used as a new tool to estimate the crystallinity of chelates as well as to elucidate their geometrical structures.

  13. The theory and geological application of ternary statistics

    Science.gov (United States)

    Cooper, D. H.

    A statistical procedure for defining the relationship of three interdependent variables was developed. A plotting scheme was devised which would reduce any three variable values to a single representative point. The centroid of a triangle formed by the three input values provided the best definition for such a point. Ternary statistical plots were made of geological data which were previously analyzed using conventional statistical and graphical methods. In instances where multiple plots were needed to define the correlation of three variables, ternary statistical analysis reduced the same correlation to a single plot. Ternary statistical plots emphasized features not shown on the conventional plots. Ternary statistical techniques provided a more complete and less complex approach.

  14. An efficient ternary serial adder based on carbon nanotube FETs

    Directory of Open Access Journals (Sweden)

    Mohammad Hossein Moaiyeri

    2016-03-01

    Full Text Available This paper presents an efficient ternary serial adder for nanotechnology employing negative, positive and standard ternary logics. Multiple-valued logic results in chips with more density, less complexity and high-bandwidth data transfer. The unique properties of CNTFETs such as the capability of adapting the desired threshold voltage by changing the diameters of the nanotubes and same carrier mobility for the n-type and p-type devices play an important role in designing this circuit. The proposed design method considerably reduces the number of required devices of a ternary serial adder. In addition, the results of the simulations conducted using HSPICE with the Stanford comprehensive 32 nm CNTFET model, demonstrate improvements in terms of speed and power-delay product as compared to the cutting-edge CNTFET-based ternary designs.

  15. 氧化锆陶瓷中温化学镀镍三元络合剂的研究%Study on Ternary Complexing Agent for Medium-temperature Electroless Nickel Plating on Zirconia Ceramics

    Institute of Scientific and Technical Information of China (English)

    刘鹏; 杨伏良

    2014-01-01

    Objective In order to obtain Ni-P coating with excellent performance, the ternary complexing agent for medium tem-perature was optimized. Methods By selecting lactic acid, glacial acetic acid and citric acid as complexing agents, using plating speed and phosphorus content as evaluation indicators, the effect of sodium phosphate, lactic acid, glacial acetic acid and citric acid concentration on the plating speed and phosphorus content was studied through designing L9(34 ) orthogonal experiments. Re-sults Considering the plating rate and phosphorus content, the optimal ternary complexing agent system was determined as follows:lactic acid 20 mL/ L, glacial acetic acid 15 mL/ L and citric acid 10 g/ L. The plating speed was 6. 4 milligram per hour and phos-phorus content was 8. 8wt% in this optimal system. Conclusion The results showed that even and compact Ni-P coating with good adhesion could be obtained in the optimized complexing agent system.%目的:优化中温化学镀镍三元络合剂体系,得到性能优良的化学镀镍层。方法选取乳酸、冰乙酸及柠檬酸作为络合剂组分,以镀速和含磷量为考察指标,通过设计 L9(34)正交实验,研究次亚磷酸钠、乳酸、冰乙酸及柠檬酸的浓度对化学镀镀速以及镀层磷含量的影响。结果综合考虑镀速和磷含量,得到的最佳三元络合剂体系为20 mL/ L 乳酸+15 mL/ L 冰乙酸+10 g/ L 柠檬酸,该条件下镀速为6.4 mg/ h,镀层磷质量分数为8.8%。结论采用优化的络合剂体系,可以获得致密均匀、结合力良好的化学镀镍层。

  16. Crystal structure of the ternary complex of the catalytic domain of human phenylalanine hydroxylase with tetrahydrobiopterin and 3-(2-thienyl)-L-alanine, and its implications for the mechanism of catalysis and substrate activation.

    Science.gov (United States)

    Andersen, Ole Andreas; Flatmark, Torgeir; Hough, Edward

    2002-07-26

    Phenylalanine hydroxylase catalyzes the stereospecific hydroxylation of L-phenylalanine, the committed step in the degradation of this amino acid. We have solved the crystal structure of the ternary complex (hPheOH-Fe(II).BH(4).THA) of the catalytically active Fe(II) form of a truncated form (DeltaN1-102/DeltaC428-452) of human phenylalanine hydroxylase (hPheOH), using the catalytically active reduced cofactor 6(R)-L-erythro-5,6,7,8-tetrahydrobiopterin (BH(4)) and 3-(2-thienyl)-L-alanine (THA) as a substrate analogue. The analogue is bound in the second coordination sphere of the catalytic iron atom with the thiophene ring stacking against the imidazole group of His285 (average interplanar distance 3.8A) and with a network of hydrogen bonds and hydrophobic contacts. Binding of the analogue to the binary complex hPheOH-Fe(II).BH(4) triggers structural changes throughout the entire molecule, which adopts a slightly more compact structure. The largest change occurs in the loop region comprising residues 131-155, where the maximum r.m.s. displacement (9.6A) is at Tyr138. This loop is refolded, bringing the hydroxyl oxygen atom of Tyr138 18.5A closer to the iron atom and into the active site. The iron geometry is highly distorted square pyramidal, and Glu330 adopts a conformation different from that observed in the hPheOH-Fe(II).BH(4) structure, with bidentate iron coordination. BH(4) binds in the second coordination sphere of the catalytic iron atom, and is displaced 2.6A in the direction of Glu286 and the iron atom, relative to the hPheOH-Fe(II).BH(4) structure, thus changing its hydrogen bonding network. The active-site structure of the ternary complex gives new insight into the substrate specificity of the enzyme, notably the low affinity for L-tyrosine. Furthermore, the structure has implications both for the catalytic mechanism and the molecular basis for the activation of the full-length tetrameric enzyme by its substrate. The large conformational change, moving

  17. Ternary fission of (_

    Directory of Open Access Journals (Sweden)

    Dariush Naderi

    2017-05-01

    Full Text Available Using three cluster model, the ternary fission of (_"98" ^"252" Cf is studied. We applied collinear and equatorial configurations to study the ternary fission of (_"98" ^"252" Cf when three fragments are Sn, Ni and Ca. The potential energy of collinear and equatorial configurations is calculated. We calculated the potential energy for odd and even values of A3. Also, we compared the potential energy for (_"50" ^(A_"1" Sn+(_"28" ^(A_"2" Ni+(_"20" ^(A_"3" Ca and (_"50" ^(A_"1" -"1" Sn+(_"28" ^(A_"2" +"1" Ni+(_"20" ^(A_"3" Ca to investigate the influence of neutron numbers of three fragments. Obtained results show that for (_"50" ^(A_"1" Sn+(_"28" ^(A_"2" Ni+(_"20" ^(A_"3" Ca reaction with even A3 in collinear and equatorial configurations, the potential energy and penetration probability have ,respectively, minimum and maximum values in A3=48 whereas for odd values of A3 the minimum value for the potential energy and the maximum value of penetration probability take place in A3=49. For (_"50" ^(A_"1" -"1" Sn+(_"28" ^(A_"2" +"1" Ni+(_"20" ^(A_"3" Ca reactions in collinear and equatorial cases, the minimum value of potential energy and maximum value of penetration probability take place in A3=49 and A3=50, respectively, for even and odd values of A3. Also, among all the possible reactions the lowest value of potential energy and highest value of penetration probability happen for (_"50" ^132Sn+(_"28" ^72Ni+(_"20" ^48Ca configuration.

  18. Syntheses and electroluminescent properties of two europium ternary complexes Eu(DBM){sub 3}(PBO) and Eu(DBM){sub 3}(PBT)

    Energy Technology Data Exchange (ETDEWEB)

    Guan Min [State Key Laboratory of Rare Earth Materials Chemistry and Applications, Peking University, Beijing 100871 (China); Gao Lihua [Department of Chemistry, Beijing Normal University, Beijing 100875 (China); Wang Shanshan [State Key Laboratory of Rare Earth Materials Chemistry and Applications, Peking University, Beijing 100871 (China); Huang Chunhui [State Key Laboratory of Rare Earth Materials Chemistry and Applications, Peking University, Beijing 100871 (China)], E-mail: chhuang@pku.edu.cn; Wang Kezhi [Department of Chemistry, Beijing Normal University, Beijing 100875 (China)

    2007-12-15

    Two europium complexes, Eu(DBM){sub 3}(PBO) and Eu(DBM){sub 3}(PBT) (DBM=dibenzoylmethanato, PBO=2-(2-pyridyl)benzoxazole, PBT=2-(2-pyridyl)benzothiazole), were prepared and used as emitting materials in organic electroluminescent (EL) devices. The devices with the structures ITO/TPD/Eu(DBM){sub 3}(PBO) (or Eu(DBM){sub 3}(PBT)/BCP/Alq{sub 3}/Mg:Ag/Ag emit red light originating from the europium complexes.

  19. 邻菲咯啉-磺基丙氨酸钴(Ⅱ)配合物的合成与晶体结构%Synthesis and Crystal Structure of Phenanthroline-Cysteic Acid Cobalt(Ⅱ) Ternary Complex

    Institute of Scientific and Technical Information of China (English)

    李海叶; 蒋毅民; 蒙秀金

    2013-01-01

    A ternary complex [CoL(phen)2]H2O (L = L-sulfosalicylic alanine,phen = l,10-phenanthro-line) was synthesized with metal cobalt ( I ) salts and L-cysteic acid and phenanthroline. The structure of the complex was characterized by infrared spectroscopy and X-ray diffraction. The crystal structure shows that its space group is P2(l)/c,and unit cell parameters are:a = l. 042 44(11) nm,b=l. 560 74 (14) nm,c=1.676 03(19) nm,β=90. 425(7)%z = 4,the final factor R1 =0.148 2,wRz = 0. 282 7. In the complex the central metal ions exhibit distorted octahedral geometries.%以金属钴(Ⅱ)盐与L-磺基丙氨酸和邻菲咯咻配体合成了三元配合物[CoL (phen)2]H2O (L=L-磺基丙氨酸,phen=邻菲咯啉),并对其进行红外光谱和X射线衍射等表征.晶体结构分析表明,配合物的空间群P2(1)/c,晶胞参数:a=1.042 4(11) nm,b=1.560 7(14) nm,c=1.676 0(19) nm,β=90.425(7)°,Z=4,最终偏离因子R1=0.148 2,wR2=0.282 7.中心钴离子采取六配位的畸变八面体结构.

  20. Synthesis, structural characterization and cytotoxic activity of ternary copper(II)-dipeptide-phenanthroline complexes. A step towards the development of new copper compounds for the treatment of cancer.

    Science.gov (United States)

    Iglesias, Sebastián; Alvarez, Natalia; Torre, María H; Kremer, Eduardo; Ellena, Javier; Ribeiro, Ronny R; Barroso, Rafael P; Costa-Filho, Antonio J; Kramer, M Gabriela; Facchin, Gianella

    2014-10-01

    In the search for new compounds with antitumor activity, coordination complexes with different metals are being studied by our group. This work presents the synthesis and characterization of six copper complexes with general stoichiometry [Cu(L-dipeptide)(phen)]·nH2O (were phen=1,10-phenanthroline) and their cytotoxic activities against tumor cell lines. To characterize these systems, analytical and spectroscopic studies were performed in solid state (by UV-visible, IR, X-ray diffraction) including the crystal structure of four new complexes (of the six complexes studied): [Cu(Ala-Phe)(phen)]·4H2O, [Cu(Phe-Ala)(phen)]·4H2O, [Cu(Phe-Val)(phen)]·4.5H2O and [Cu(Phe-Phe)(phen)]·3H2O. In all of them, the copper ion is situated in a distorted squared pyramidal environment. The phen ligand is perpendicular to the dipeptide, therefore exposed and potentially available for interaction with biological molecules. In addition, for all the studied complexes, structural information in solution using EPR and UV-visible spectroscopies were obtained, showing that the coordination observed in solid state is maintained. The lipophilicity, DNA binding and albumin interaction were also studied. Biological experiments showed that all the complexes induce cell death in the cell lines: HeLa (human cervical adenocarcinoma), MCF-7 (human metastatic breast adenocarcinoma) and A549 (human lung epithelial carcinoma). Among the six complexes, [Cu(Ala-Phe)(phen)] presents the lowest IC50 values. Taken together all these data we hypothesize that [Cu(Ala-Phe)(phen)] may be a good candidate for further studies in vivo.

  1. Ternary complexes of copper(II) and cobalt(II) involving nitrite/pyrazole and tetradentate N4-coordinate ligand: Synthesis, characterization, structures and antimicrobial activity

    Science.gov (United States)

    Solanki, Ankita; Sadhu, Mehul H.; Kumar, Sujit Baran

    2015-12-01

    Five new mononuclear mixed ligand complexes of the type [Cu(NCCH3)(dbdmp)](ClO4)2, [M(ONO)(dbdmp)]ClO4, [M(pz) (dbdmp)](ClO4)2 where M = Cu(II) and Co(II), pz = 3,5-dimethylpyrazole and dbdmp = N,N-diethyl-N‧,N‧-bis((3,5-dimethyl-1H-pyrazol-1-yl)methyl)ethane-1,2-diamine have been synthesized and characterized by physico-chemical and spectroscopy studies. The crystal structures of three copper(II) complexes [Cu(NCCH3)(dbdmp)](ClO4)2, [Cu(ONO)(dbdmp)]ClO4 and [Cu(pz)(dbdmp)](ClO4)2 have been determined by single crystal X-ray diffraction studies. Structural analyses reveal the geometry of [Cu(pz)(dbdmp)](ClO4)2 is distorted square pyramidal and other two copper(II) complexes have distorted trigonal bipyramidal geometry. Molecular composition of cobalt(II) complexes have been determined by mass spectral data. The EPR spectra of copper(II) complexes in frozen acetonitrile solution exhibit axial spectra, characteristic of dx2-y2 ground state. Electrochemical studies of copper(II) complexes using glassy carbon as working electrode in acetonitrile solution show Cu(II)/Cu(I) couple with quasi reversible electron transfer versus Ag/Ag+ reference electrode. Antimicrobial activity of all the synthesized complexes were investigated against two Gram positive and two Gram negative bacterial strains.

  2. Parity violation in ternary fission

    Science.gov (United States)

    Gönnenwein, F.; Belozerov, A. V.; Beda, A. G.; Burov, S. I.; Danilyan, G. V.; Martem'yanov, A. N.; Pavlov, V. S.; Shchenev, V. A.; Bondarenko, L. N.; Mostovoĭ, Yu. A.; Geltenbort, P.; Last, J.; Schreckenbach, K.

    1994-01-01

    The parity-violating correlation between incoming neutron spin and fragment momentum has been measured simultaneously for binary and ternary fission of 233U(n, f) and 239Pu(n, f). The experiment has been performed with a polarized cold neutron beam of the Institut Laue-Langevin in Grenoble/France. The ratios of the parity-violating asymmetry coefficients, α ternf and α binnf, for ternary and binary fission, respectively, are found to be {α ternf}/{α binnf = 1.05 ± 0.10 } and 1.12 ± 0.08 for the 233U and 239Pu target nucleus, respectively. Both experiments are compatible with {α ternf}/{α binnf = 1 }. The implications of this result for models of ternary fission are discussed. The conclusion drawn is that ternary particles are emitted at the very last stage of fission.

  3. Binary and ternary copper(II) complexes of a tridentate ONS ligand derived from 2-aminochromone-3 carboxaldehyde and thiosemicarbazide: Synthesis, spectral studies and antimicrobial activity

    Science.gov (United States)

    Shebl, Magdy; Ibrahim, M. A.; Khalil, Saied M. E.; Stefan, S. L.; Habib, H.

    2013-11-01

    A tridentate ONS donor ligand, HL, was synthesized by the condensation of 2-aminochromone-3-carboxaldehyde with thiosemicarbazide. The structure of the ligand was elucidated by elemental analyses, IR, 1H and 13C NMR, electronic and mass spectra. Reaction of the ligand with several copper(II) salts, including AcO-, NO3-, SO42-, Cl-, Br- and ClO4- afforded different metal complexes that reflect the non-coordinating or weakly coordinating power of the ClO4- and Br- anions as compared to the strongly coordinating power of AcO-, SO42-, Cl- and NO3- anions. Also, the ligand was allowed to react with Cu(II) ion in the presence of a secondary ligand (L‧) [N,O-donor; 8-hydroxyquinoline or N,N-donor; 1,10-phenanthroline]. Characterization and structure elucidation of the prepared complexes were achieved by elemental and thermal analyses, IR, electronic, mass and EPR spectra as well as conductivity and magnetic susceptibility measurements. The EPR spin Hamiltonian parameters of some complexes were calculated. The metal complexes exhibited octahedral and square planar geometrical arrangements depending on the nature of the anion. The ligand and most of its metal complexes showed antibacterial activity towards Gram-positive bacteria (Staphylococcus aureus and Bacillus subtilis), Gram-negative bacteria (Salmonella typhimurium and Escherichia coli), yeast (Candida albicans) and fungus (Aspergillus fumigatus).

  4. Necessary conditions for ternary algebras

    Energy Technology Data Exchange (ETDEWEB)

    Fairlie, David B [Department of Mathematical Sciences, University of Durham, Science Laboratories, South Rd, Durham DH1 3LE (United Kingdom); Nuyts, Jean, E-mail: david.fairlie@durham.ac.u, E-mail: jean.nuyts@umons.ac.b [Physique Theorique et Mathematique, Universite de Mons, 20 Place du Parc, B-7000 Mons (Belgium)

    2010-11-19

    Ternary algebras, constructed from ternary commutators, or as we call them, ternutators, defined as the alternating sum of products of three operators, have been shown to satisfy cubic identities as necessary conditions for their existence. Here we examine the situation where we permit identities not solely constructed from ternutators or nested ternutators and we find that in general, these impose additional restrictions; for example, the anti-commutators or commutators of the operators must obey some linear relations among themselves.

  5. Ternary generalizations of Grassmann algebra

    CERN Document Server

    Abramov, V V

    1996-01-01

    We propose the ternary generalization of the classical anti-commutativity and study the algebras whose generators are ternary anti-commutative. The integral over an algebra with an arbitrary number of generators N is defined and the formula of a change of variables is proved. In analogy with the fermion integral we define an analogue of the Pfaffian for a cubic matrix by means of Gaussian type integral and calculate its explicit form in the case of N=3.

  6. Synthesis and Luminescence Properties of a Reactive Ternary Europium Complex Containing 1, 10-Phenanthroline%基于邻菲咯啉的反应型三元铕配合物的合成与荧光性质

    Institute of Scientific and Technical Information of China (English)

    徐存进; 施燕琴

    2013-01-01

    以二苯甲酰甲烷(HDBM)为第一配体,5-丙烯酰胺基-1,10-菲咯啉(Aphen)为活性第二配体,制备了新的反应型三元铕配合物Eu(DBM)3Aphen.通过元素分析、红外光谱和热分析对配合物进行了组成确定,采用紫外光谱、荧光光谱、荧光寿命和荧光量子产量研究了配合物的光物理性能.结果表明,在紫外光激发下,配合物Eu(DBM)3Aphen能发射Eu3+的特征荧光,其荧光发射强度、单色性、荧光寿命和荧光量子产率等均显著高于文献报道的丙烯酸配合物Eu(DBM)2AA的相应数值,表明配合物Eu(DBM)3 Aphen不仅可作为潜在的红色发光材料,还可作为反应型的配合物,为制备具有优异发光性能的稀土聚合物提供了一条新的途径.%With dibenzoylmethane (HDBM) as the first ligand and 5-acrylamido-l, 10-phenanthroline as the secondary ligand, a new reactive ternary europium complex, Eu(DBM)3Aphen, was prepared and characterized by elemental analysis, IR spectra and TG-DTG. Its photophysical properties were studied by using UV, luminescence spectra, lifetime and quantum yield measurements. The complex Eu(DBM)3 Aphen showed characteristic luminescence of europium ions under UV excitation. Compared with the complex Eu(DBM)2 AA reported in the literature, complex Eu(DBM)3 Aphen exhibited much stronger luminescence intensity, higher monochromaticity, longer lifetime and higher efficiency. The results showed that the complex Eu(DBM)3 Aphen would be not only a potential red-emitting material but also a reactive complex, which would provide a new way for the synthesis of rare earth polymer with outstanding luminescence properties.

  7. Structural Insights into the Dual Strategy of Recognition by Peptidoglycan Recognition Protein, PGRP-S: Structure of the Ternary Complex of PGRP-S with Lipopolysaccharide and Stearic Acid

    Science.gov (United States)

    Sharma, Pradeep; Dube, Divya; Sinha, Mau; Yadav, Savita; Kaur, Punit; Sharma, Sujata; Singh, Tej P.

    2013-01-01

    Peptidoglycan recognition proteins (PGRPs) are part of the innate immune system. The 19 kDa Short PGRP (PGRP-S) is one of the four mammalian PGRPs. The concentration of PGRP-S in camel (CPGRP-S) has been shown to increase considerably during mastitis. The structure of CPGRP-S consists of four protein molecules designated as A, B, C and D forming stable intermolecular contacts, A–B and C–D. The A–B and C–D interfaces are located on the opposite sides of the same monomer leading to the the formation of a linear chain with alternating A–B and C–D contacts. Two ligand binding sites, one at C–D contact and another at A–B contact have been observed. CPGRP-S binds to the components of bacterial cell wall molecules such as lipopolysaccharide (LPS), lipoteichoic acid (LTA), and peptidoglycan (PGN) from both Gram-positive and Gram-negative bacteria. It also binds to fatty acids including mycolic acid of the Mycobacterium tuberculosis (Mtb). Previous structural studies of binary complexes of CPGRP-S with LPS and stearic acid (SA) have shown that LPS binds to CPGRP-S at C–D contact (Site-1) while SA binds to it at the A–B contact (Site-2). The binding studies using surface plasmon resonance showed that LPS and SA bound to CPGRP-S in the presence of each other. The structure determination of the ternary complex showed that LPS and SA bound to CPGRP-S at Site-1 and Site-2 respectively. LPS formed 13 hydrogen bonds and 159 van der Waals contacts (distances ≤4.2 Å) while SA formed 56 van der Waals contacts. The ELISA test showed that increased levels of productions of pro-inflammatory cytokines TNF-α and IFN-γ due to LPS and SA decreased considerably upon the addition of CPGRP-S. PMID:23326499

  8. Induction of cell death by ternary copper(II) complexes of L-tyrosine and diimines: role of coligands on DNA binding and cleavage and anticancer activity.

    Science.gov (United States)

    Ramakrishnan, Sethu; Rajendiran, Venugopal; Palaniandavar, Mallayan; Periasamy, Vaiyapuri Subbarayan; Srinag, Bangalore Suresh; Krishnamurthy, Hanumanthappa; Akbarsha, Mohammad Abdulkader

    2009-02-16

    The mononuclear mixed ligand copper(II) complexes of the type [Cu(L-tyr)(diimine)](ClO(4)), where tyr is L-tyrosine and diimine is 2,2'-bipyridine (bpy) (1), 1,10-phenanthroline (phen) (2), 5,6-dimethyl-1,10-phenanthroline (5,6-dmp) (3), and dipyrido[3,2-d:2',3'-f]quinoxaline (dpq) (4), have been isolated and characterized by analytical and spectral methods. In the X-ray crystal structure 3 Cu(II) possesses a distorted square pyramidal coordination geometry with the two nitrogen atoms of 5,6-dmp ligand and the amine nitrogen and carboxylate oxygen atoms of L-tyrosine located at the equatorial sites and the coordinated water molecule present in the apical position. The electronic absorption and electron paramagnetic resonance (EPR) spectral parameters reveal that the complexes retain their square-based geometries even in solution. All of the complexes display a ligand field band in the visible region (600-700 nm) in Tris-HCl/NaCl buffer (5:50 mM) at pH 7.2 and also axial EPR spectra in acetonitrile at 77 K with g(parallel) > g(perpendicular) indicating a d(x(2)-y(2)) ground state. The g(parallel) and A(parallel) values of 2.230 and (170-180) x 10(-4) cm(-1), respectively, conform to a square-based CuN(3)O coordination chromophore, which is consistent with the X-ray crystal structure of 3. The interaction of the complexes with calf thymus DNA (CT DNA) has been explored by using physical methods to propose modes of DNA binding of the complexes. Absorption (K(b)) and emission spectral studies and viscosity measurements indicate that 4 interacts with DNA more strongly than all of the other complexes through partial intercalation of the extended planar ring of dpq with DNA base stack. Interestingly, complex 3 exhibits a DNA binding affinity that is higher than that of 2, which suggests the involvement of 5,6-dimethyl groups on the phen ring in hydrophobic interaction with DNA surface. In contrast with the increase in relative viscosities of DNA bound to 2-4, the

  9. Co-motif discovery identifies an Esrrb-Sox2-DNA ternary complex as a mediator of transcriptional differences between mouse embryonic and epiblast stem cells.

    Science.gov (United States)

    Hutchins, Andrew Paul; Choo, Siew Hua; Mistri, Tapan Kumar; Rahmani, Mehran; Woon, Chow Thai; Ng, Calista Keow Leng; Jauch, Ralf; Robson, Paul

    2013-02-01

    Transcription factors (TF) often bind in heterodimeric complexes with each TF recognizing a specific neighboring cis element in the regulatory region of the genome. Comprehension of this DNA motif grammar is opaque, yet recent developments have allowed the interrogation of genome-wide TF binding sites. We reasoned that within this data novel motif grammars could be identified that controlled distinct biological programs. For this purpose, we developed a novel motif-discovery tool termed fexcom that systematically interrogates ChIP-seq data to discover spatially constrained TF-TF composite motifs occurring over short DNA distances. We applied this to the extensive ChIP-seq data available from mouse embryonic stem cells (ESCs). In addition to the well-known and most prevalent sox-oct motif, we also discovered a novel constrained spacer motif for Esrrb and Sox2 with a gap of between 2 and 8 bps that Essrb and Sox2 cobind in a selective fashion. Through the use of knockdown experiments, we argue that the Esrrb-Sox2 complex is an arbiter of gene expression differences between ESCs and epiblast stem cells (EpiSC). A number of genes downregulated upon dual Esrrb/Sox2 knockdown (e.g., Klf4, Klf5, Jam2, Pecam1) are similarly downregulated in the ESC to EpiSC transition and contain the esrrb-sox motif. The prototypical Esrrb-Sox2 target gene, containing an esrrb-sox element conserved throughout eutherian and metatherian mammals, is Nr0b1. Through positive regulation of this transcriptional repressor, we argue the Esrrb-Sox2 complex promotes the ESC state through inhibition of the EpiSC transcriptional program and the same trio may also function to maintain trophoblast stem cells.

  10. Dynamic studies of H-Ras•GTPγS interactions with nucleotide exchange factor Sos reveal a transient ternary complex formation in solution.

    Science.gov (United States)

    Vo, Uybach; Vajpai, Navratna; Embrey, Kevin J; Golovanov, Alexander P

    2016-07-14

    The cycling between GDP- and GTP- bound forms of the Ras protein is partly regulated by the binding of Sos. The structural/dynamic behavior of the complex formed between activated Sos and Ras at the point of the functional cycle where the nucleotide exchange is completed has not been described to date. Here we show that solution NMR spectra of H-Ras∙GTPγS mixed with a functional fragment of Sos (Sos(Cat)) at a 2:1 ratio are consistent with the formation of a rather dynamic assembly. H-Ras∙GTPγS binding was in fast exchange on the NMR timescale and retained a significant degree of molecular tumbling independent of Sos(Cat), while Sos(Cat) also tumbled largely independently of H-Ras. Estimates of apparent molecular weight from both NMR data and SEC-MALS revealed that, at most, only one H-Ras∙GTPγS molecule appears stably bound to Sos. The weak transient interaction between Sos and the second H-Ras∙GTPγS may provide a necessary mechanism for complex dissociation upon the completion of the native GDP → GTP exchange reaction, but also explains measurable GTP → GTP exchange activity of Sos routinely observed in in vitro assays that use fluorescently-labelled analogs of GTP. Overall, the data presents the first dynamic snapshot of Ras functional cycle as controlled by Sos.

  11. Ternary complex structures of human farnesyl pyrophosphate synthase bound with a novel inhibitor and secondary ligands provide insights into the molecular details of the enzyme’s active site closure

    Directory of Open Access Journals (Sweden)

    Park Jaeok

    2012-12-01

    Full Text Available Abstract Background Human farnesyl pyrophosphate synthase (FPPS controls intracellular levels of farnesyl pyrophosphate, which is essential for various biological processes. Bisphosphonate inhibitors of human FPPS are valuable therapeutics for the treatment of bone-resorption disorders and have also demonstrated efficacy in multiple tumor types. Inhibition of human FPPS by bisphosphonates in vivo is thought to involve closing of the enzyme’s C-terminal tail induced by the binding of the second substrate isopentenyl pyrophosphate (IPP. This conformational change, which occurs through a yet unclear mechanism, seals off the enzyme’s active site from the solvent environment and is essential for catalysis. The crystal structure of human FPPS in complex with a novel bisphosphonate YS0470 and in the absence of a second substrate showed partial ordering of the tail in the closed conformation. Results We have determined crystal structures of human FPPS in ternary complex with YS0470 and the secondary ligands inorganic phosphate (Pi, inorganic pyrophosphate (PPi, and IPP. Binding of PPi or IPP to the enzyme-inhibitor complex, but not that of Pi, resulted in full ordering of the C-terminal tail, which is most notably characterized by the anchoring of the R351 side chain to the main frame of the enzyme. Isothermal titration calorimetry experiments demonstrated that PPi binds more tightly to the enzyme-inhibitor complex than IPP, and differential scanning fluorometry experiments confirmed that Pi binding does not induce the tail ordering. Structure analysis identified a cascade of conformational changes required for the C-terminal tail rigidification involving Y349, F238, and Q242. The residues K57 and N59 upon PPi/IPP binding undergo subtler conformational changes, which may initiate this cascade. Conclusions In human FPPS, Y349 functions as a safety switch that prevents any futile C-terminal closure and is locked in the “off” position in the

  12. Interaction of ternary polypyridine-copper( Ⅱ )- L-α-amino acid complexes with DNA%多吡啶-铜(Ⅱ)-L-α-氨基酸配合物与DNA的作用

    Institute of Scientific and Technical Information of China (English)

    陈佳阳; 任祥祥; 古琴; 乐学义

    2011-01-01

    应用电子吸收光谱、荧光光谱、粘度测定及琼脂糖凝胶电泳法研究了多吡啶-铜(Ⅱ)-L-α-氨基酸型配合物:[Cu(TATP)(L-Val) (H2O)]ClO4·0.5H2O (1)、[Cu(IP)(L-Val)(H2O)]ClO4·1.5H2O (2) 、[Cu(TATP)(L-Tyr)(H2O)]ClO4·H2O(3) 和[Cu(IP)(L-Tyr) (H2O)] ClO4·H2O(4)(TATP=1,4,8,9-四氮三联苯,IP=咪唑并[5,6-f][1,10]邻菲咯啉,L-Val=L-缬氨酸,L- Tyr=L-酪氨酸)与DNA的相互作用.结果表明,作用模式为经典插入作用,且在维生素C存在下配合物对pBR322 DNA具有显著的切割作用,作用大小次序为:配合物1>2>3>4.%The interaction of ternary Cu ( Ⅱ ) complexes [ Cu (TATP) (L-Val) ( H2 0) ] ClO4·0.5 H20(1)、[Cu(IP)(L-Val) (H20) ] ClO4 · 1. 5H20 (2)、[Cu(TATP) (L-Tyr) ( H2 O) ] ClO4 · H20(3) and [ Cu(IP) (L-Tyr) (H2O) ]ClO4 · H20(4)(TATP = 1,4,8,9-tetraaza triphenylen, IP = imidazo-[4,5-f] [ 1,10 ] phenanthroline, L-Val = L-Valinate, L-Tyr = L-Tyrosinate)with DNA have been investigated by electronic absorption spectroscopy, ethidium bromide (EB) fluorescence spectroscopy, and viscosity measurements. The results indicate that the complexes may bind to DNA by intercalative mode and have very strong binding affinities to DNA with the order: complex 1 > 2 > 3 > 4. Moreover, the result of agarose gel electrophoresis shows that the complexes have high cleaving efficiency to pBR322 DNA in the presence of vitamin C.

  13. Synthesis and Crystal Structure of a New Ternary Mixed Ligand Complex [Cu(ampym)(bapa)Cl](ClO4) (ampym = 2-Aminopyrimidine, bapa = Bi(3-aminopropyl)amine)

    Institute of Scientific and Technical Information of China (English)

    2006-01-01

    The title complex [Cu(ampym)(bapa)Cl](ClO4) (C10H22Cl2CuN6O4) was synthesized and characterized by elemental analysis, IR and X-ray single-crystal diffraction. The crystal crystalli- zes in the orthorhombic system, space group Pna21 with a = 11.9904(12), b = 15.9796(16), c = 8.9143(9)(A), V = 1708.0(3)(A)3, Mr = 424.78, Z = 4, F(000) = 876, Dc = 1.652 g/cm3, T = 293 K, μ = 1.619 mm-1 and λ = 0.71073(A). The structure was refined to R = 0.0240 and wR = 0.0564 for 2905 observed reflections with I > 2σ(I). Flack = 0.039(12).

  14. Error Correcting Coding for a Non-symmetric Ternary Channel

    CERN Document Server

    Bitouze, Nicolas; Rosnes, Eirik

    2009-01-01

    Ternary channels can be used to model the behavior of some memory devices, where information is stored in three different levels. In this paper, error correcting coding for a ternary channel where some of the error transitions are not allowed, is considered. The resulting channel is non-symmetric, therefore classical linear codes are not optimal for this channel. We define the maximum-likelihood (ML) decoding rule for ternary codes over this channel and show that it is complex to compute, since it depends on the channel error probability. A simpler alternative decoding rule which depends only on code properties, called $\\da$-decoding, is then proposed. It is shown that $\\da$-decoding and ML decoding are equivalent, i.e., $\\da$-decoding is optimal, under certain conditions. Assuming $\\da$-decoding, we characterize the error correcting capabilities of ternary codes over the non-symmetric ternary channel. We also derive an upper bound and a constructive lower bound on the size of codes, given the code length and...

  15. Synthesis, Characterization and Luminescence Properties of Novel β-Diketone and Eu( Ⅲ ) Ternary Complex%新型β-二酮配体及其Eu(Ⅲ)三元配合物的合成、表征及发光性能的研究

    Institute of Scientific and Technical Information of China (English)

    程果; 魏长平; 任晓明; 王贺; 魏文涛

    2011-01-01

    The novel β-diketone l-(4-bromophenyl)-3-phenylpropane-l, 3-dione (L) was synthesized at room temperature by classical Claisen condensation reaction. With the β-diketone L as the first ligand and phen as the secondary ligand, and a new rare-earth Eu (Ⅲ) ternary complex was prepared. The ligand L and ternary complex were characterized by elemental analysis, IR spectra. UV spectra and fluorescence spectra. IR spectra indicated that; the novel ligand L contained the structure of p-dike-tone, where the content of enol was highs the Eu3+ ion in the ternary complex was coordinated with six oxygen atoms of three L ligands and two nitrogen atoms of the second ligand phen. UV spectra showed that the main absorption was from the first ligand L in the Eu ( Ⅲ) ternary complex. The excitation and emission spectra of the ternary complex were measured and investigated. Fluorescence spectra demonstrated that the ternary complex could emit characteristic fluorescence of rare earth Eu3+ ion and the strongest emission band was narrow which was attributed to the 5 D0→7 Fz transitions of the 4f electrons of the central Eu3+ ions. So. The new Eu( Ⅲ ) ternary complex is an excellent red-emitter which would be regarded as a valuable material with bright red fluorescence because it presents good monochromaticity.%采用Claisen缩合反应合成了一种新型的β-二酮化合物1-(4-溴苯)-3-苯基丙烷-1,3-二酮(L),并以其为第一配体,邻菲罗啉( Phen)为第二配体,合成出新型稀土Eu(Ⅲ)三元配合物.通过元素分析、红外光谱、紫外光谱、荧光光谱对合成的配体及三元配合物进行了表征.红外光谱的分析表明:配体L含有β-二酮结构,且烯醇式含量高;配合物中L的氧原子以及Phen中的氮原子与稀土离子进行了配位.紫外光谱的分析表明配合物中的能量传递主要来自第一配体.通过荧光光谱研究了配合物的发光性质,结果显示配合物表现出Eu3+的特

  16. Thermochemical Study on Ternary Solid Complex of La(Gly)2(Ala)3Cl3·2H2O (s)

    Institute of Scientific and Technical Information of China (English)

    Ye Lijuan; Li Qiangguo; Li Xu; Yang Dejun; Liu Yi

    2007-01-01

    The complex of lanthanum chloride with Glycine and Alanine, La(Gly)2(Ala)3Cl3·2H2O, was synthesized and characterized by IR, elementary analysis, thermogravimetric analysis, and chemical analysis. The dissolution enthalpies of LaCl3 ·7H2O(s), 2Gly(s) + 3Ala(s) and La(Gly)2(Ala)3Cl3 ·2H2O(s) were determined in 2 mol·L-1 HCl by a solution-reaction isoperibol calorimeter. By designing a thermochemical cycle in terms of Hess′ Law and through calculation, the reaction enthalpy of lanthanum chloride seven-hydrate with Glycine and Alanine was obtained: ΔrHθm (298.15 K)=(29.652±0.504) kJ·mol-1, and the standard enthalpy of formation of La(Gly)2(Ala)3Cl3·2H2O(s) ΔfHθm [La(Gly)2(Ala)3Cl3·2H2O, s, 298.15 K]=-4467.6±8.3 kJ·mol-1.

  17. A theoretical investigation into the cooperativity effect involving anionic hydrogen bond and aromaticity in Cl-…benzonitrile…H2 O ternary complex%Cl-…苯氰…H2O中阴离子氢键协同效应与芳香性理论研究

    Institute of Scientific and Technical Information of China (English)

    宋慧; 李斌; 赵光明; 武红娟; 龙泽清

    2015-01-01

    本文采用DFT-B3LYP和MP2(full)方法对三聚体Cl–…苯氰…H2O中O/C–H…Cl–阴离子氢键与传统氢键O–H…N和C–H…O之间的协同效应、热力学性质以及芳香性进行了研究.结果表明阴离子氢键O/C–H…Cl–对O–H…N或 C–H…O相互作用的影响更显著.在线性结构中发生正协同效应,熵变是促进热力学协同效应的主要因素,而在环状结构中发生反协同效应,焓变成为主要因素.在三聚体形成过程中,苯氰环的芳香性是减弱的,而苯氰中π→π∗共轭效应是增强的.结果表明,协同效应能Ecoop.分别与 Rc ( NICS (1) ternary/NICS (1) binary ),ΔΔδ(Δδternary -Δδbinary ), Rc′(( NICS (1) ternary - NICS (1)binary)/NICS (1)binary)和RBDE(C–CN)(BDE(C–CN)ternary/BDE(C–CN)binary)均具有良好的线性关系.同时, AIM的分析也佐证了协同效应的存在.%The cooperativity effects between the O/C–H…Cl–anionic H-bonding and O–H…N and C–H…O H-bonding interactions, thermodynamic properties and aromaticities in Cl–…benzonitrile…H2 O comple-xes are investigated using the B3LYP and MP2(full) methods. The result shows that the influence of the O/C–H…Cl–anionic H-bonding interaction on the C–H…O is more pronounced than that on the O–H…N in-teraction. The cooperativity effect appears in the linear conformation while the anti-cooperativity effect is found in the cyclic structure. The enthalpy change is the major factor driving the cooperativity in forming the linear ter-nary complex while entropy change turns into the favorable factor in forming the cyclic system. The aromaticity of the benzonitrile ring is weakened and theπ→π∗conjugative effect between the ring and C≡N bond is strength-ened upon the ternary-complex formation. To our interest, the cooperativity effect correlates well with Rc(NICS (1)ternary/NICS (1)binary),ΔΔδ (Δδternary– Δδbinary), Rc′((NICS (1)ternary– NICS (1

  18. Ternary Weighted Function and Beurling Ternary Banach Algebra l1ω(S

    Directory of Open Access Journals (Sweden)

    Mehdi Dehghanian

    2011-01-01

    Full Text Available Let S be a ternary semigroup. In this paper, we introduce our notation and prove some elementary properties of a ternary weight function ω on S. Also, we make ternary weighted algebra l1ω(S and show that l1ω(S is a ternary Banach algebra.

  19. Adiabatic pipelining: a key to ternary computing with quantum dots.

    Science.gov (United States)

    Pečar, P; Ramšak, A; Zimic, N; Mraz, M; Lebar Bajec, I

    2008-12-10

    The quantum-dot cellular automaton (QCA), a processing platform based on interacting quantum dots, was introduced by Lent in the mid-1990s. What followed was an exhilarating period with the development of the line, the functionally complete set of logic functions, as well as more complex processing structures, however all in the realm of binary logic. Regardless of these achievements, it has to be acknowledged that the use of binary logic is in computing systems mainly the end result of the technological limitations, which the designers had to cope with in the early days of their design. The first advancement of QCAs to multi-valued (ternary) processing was performed by Lebar Bajec et al, with the argument that processing platforms of the future should not disregard the clear advantages of multi-valued logic. Some of the elementary ternary QCAs, necessary for the construction of more complex processing entities, however, lead to a remarkable increase in size when compared to their binary counterparts. This somewhat negates the advantages gained by entering the ternary computing domain. As it turned out, even the binary QCA had its initial hiccups, which have been solved by the introduction of adiabatic switching and the application of adiabatic pipeline approaches. We present here a study that introduces adiabatic switching into the ternary QCA and employs the adiabatic pipeline approach to successfully solve the issues of elementary ternary QCAs. What is more, the ternary QCAs presented here are sizewise comparable to binary QCAs. This in our view might serve towards their faster adoption.

  20. lemmingA encodes the Apc11 subunit of the APC/C in Drosophila melanogaster that forms a ternary complex with the E2-C type ubiquitin conjugating enzyme, Vihar and Morula/Apc2

    Directory of Open Access Journals (Sweden)

    Nagy Olga

    2012-03-01

    being conserved among Drosophila species, the LmgB protein is not required for viability or fertility. Conclusions Our work provides insight into the subunit structure of the Drosophila APC/C with implications for its function. Based on the presented data, we suggest that the Lmg/Apc11 subunit recruits the E2-C type ubiquitin conjugating enzyme, Vihar, to the APC/C together with Mr/Apc2 by forming a ternary complex.

  1. Dynamic treatment of ternary fission

    Science.gov (United States)

    Rubchenya, V. A.; Yavshits, S. G.

    1988-06-01

    The new dynamic model of light charged particle (LCP) formation in ternary fission is presented. The model is based on the assumption that light particles are formed as a result of two random neck ruptures during the time interval about one single-particle period. The connection of the final stage of ternary fission and of the saddle point descent stage was obtained in the framework of the density moments method. The analysis of LCP formation has shown that LCP mass and charge distributions are strongly governed by statistical nucleon exchange in the LCP-light fragment double system. New semiclassical expressions for the calculations of LCP yields and relative ternary fission probability are given. The results of calculations are in satisfactory agreement with the experimental data.

  2. Neutronless -accompanied ternary fission of

    Science.gov (United States)

    Sandulescu, A.; Cârstoiu, F.; Misicu, S.; Florescu, A.; Ramayya, A. V.; Hamilton, J. H.; Greiner, W.

    1998-01-01

    A new type of decay corresponding to the neutronless -accompanied fragmentation of is studied. We employ a cluster model similar to the model used for the description of cluster radioactivity. No preformation factors were considered. The ternary relative isotopic yields were calculated as the ratio of the penetrability of a given ternary fragmentation over the sum of penetrabilities of all possible ternary neutronless fragmentations. The corresponding barriers between the light and heavy fragments and between the cluster and the two heavier fragments were computed with the help of a double-folding potential generated by M3Y-NN effective interaction and realistic fragment ground-state deformations. Also, we studied the influence of the fragment excitation energies on the yields, by including the level densities and the -stretching of the fragments. The new phenomenon could be experimentally observed by the triple-gamma coincidence technique between the fragments and .

  3. Factoring with qutrits: Shor's algorithm on ternary and metaplectic quantum architectures

    Science.gov (United States)

    Bocharov, Alex; Roetteler, Martin; Svore, Krysta M.

    2017-07-01

    We determine the cost of performing Shor's algorithm for integer factorization on a ternary quantum computer, using two natural models of universal fault-tolerant computing: (i) a model based on magic state distillation that assumes the availability of the ternary Clifford gates, projective measurements, classical control as its natural instrumentation set; (ii) a model based on a metaplectic topological quantum computer (MTQC). A natural choice to implement Shor's algorithm on a ternary quantum computer is to translate the entire arithmetic into a ternary form. However, it is also possible to emulate the standard binary version of the algorithm by encoding each qubit in a three-level system. We compare the two approaches and analyze the complexity of implementing Shor's period-finding function in the two models. We also highlight the fact that the cost of achieving universality through magic states in MTQC architecture is asymptotically lower than in generic ternary case.

  4. Equilibrium studies of ternary systems containing some selected transition metal ions, triazoles and aromatic carboxylic acids

    Energy Technology Data Exchange (ETDEWEB)

    Khalil, Mohamed Magdy; Radalla, Abd-Elatty; Qasem, Fatma; Khaled, Rehab [Beni-Suef University, Beni-Suef (Egypt)

    2014-01-15

    Solution equilibria of the binary and ternary complex systems of the divalent transition metal ions Cu{sup 2+}, Ni{sup 2+}, Zn{sup 2+}, and Co{sup 2+} with 1,2,4-triazole (TRZ), 3-mercapto-1,2,4-triazole (TRZSH), and 3-amino-1,2,4-triazole (TRZAM) and aromatic carboxylic acids (phthalic, anthranilic, salicylic, and 5-sulfosalicylic acid) have been studied pH-metrically at (25.0±0.1) .deg. C, and a constant ionic strength I=1x10{sup -1} mol L{sup -1} NaNO{sub 3} in an aqueous medium. The potentiometric titration curves show that binary and ternary complexes of these ligands are formed in solution. The stability constants of the different binary and ternary complexes formed were calculated on the basis of computer analysis of the titration data. The relative stability of the different ternary complex species is expressed in terms of Δ log K values, log X and R. S.% parameters. The effect of temperature of the medium on both the proton-ligand equilibria for TRZAM and phthalic acid and their metal-ligand equilibria with Cu{sup 2+}, Ni{sup 2+}, and Co{sup 2+} has been studied along with the corresponding thermodynamic parameters. The complexation behavior of ternary complexes is ascertained using conductivity measurements. In addition, the formation of ternary complexes in solution has been confirmed by using UV-visible spectrophotometry.

  5. Synthesis, Characterization and Luminescent Properties of Novel Europium,Terbium(Ⅲ) Ternary Complexes%新型铕,铽(Ⅲ)三元配合物的合成、表征及发光性能

    Institute of Scientific and Technical Information of China (English)

    程果; 魏长平; 任晓明; 王贺

    2012-01-01

    采用Claisen缩合反应设计合成了B-二酮配体1-(4-溴苯)4,4,4-三氟丁烷-1,3-二酮(BPT),并合成了相应的新型稀土Eu,Tb(Ⅲ)三元配合物.通过元素分析、1H NMR谱、红外光谱、紫外光谱、荧光光谱和磷光光谱技术对合成的产物进行了表征和分析.红外光谱分析表明:BPT中存在着酮式-烯醇式互变;配合物中的稀土离子与BPT中的氧原子以及Phen中的氮原子形成了配位键.紫外光谱表明配合物主要是由第一配体BPT吸收能量.荧光光谱显示Eu( BPT)3 Phen的发光强度较大,进一步的研究表明,BPT的最低三重态能级与Eu3+的5D0能级匹配较好.%The p-diketone l-(4-bromophenyl)-4,4, 4-trifluorobutane-l ,3-dione (BPT) was synthesized at room temperature by classical Claisen condensation reaction. And the new rare-earth Eu, Tb ( IB ) ternary complexes were prepared by a precipitation method. The ligand BPT and complexes were characterized by elemental analysis, 'H NMR spectra, IR spectra, UV spectra, fluorescence spectra and phosphorescence spectra. The IR spectra indicated that the ligand BPT contained the structure of P-diketone, where existed enol tautomer; the rare-earth ion in the complexes was coordinated with six oxygen atoms of three BPT ligands and two nitrogen atoms of the second ligand Phen. The UV spectra showed that the main absorption was from the first ligand BPT in the complexes. The excitationand emission spectra of the complexes were measured and investigated. The fluorescence spectra demonstrated that the complexes could emit characteristic fluorescence of rare-earth ion and the strongest emission band was narrow which was attributed to the transitions of the 4f electrons of the central ions. The fluorescence intensity of Eu ( BPT )3Phen was obviously higher than that of Tb ( BPT)3Phen, this indicated that the fluorescence of complexes was influenced with the matching of energy level between the triplet state of ligand BPT and the emission

  6. Structural insights into the dual strategy of recognition by peptidoglycan recognition protein, PGRP-S: structure of the ternary complex of PGRP-S with lipopolysaccharide and stearic acid.

    Directory of Open Access Journals (Sweden)

    Pradeep Sharma

    Full Text Available Peptidoglycan recognition proteins (PGRPs are part of the innate immune system. The 19 kDa Short PGRP (PGRP-S is one of the four mammalian PGRPs. The concentration of PGRP-S in camel (CPGRP-S has been shown to increase considerably during mastitis. The structure of CPGRP-S consists of four protein molecules designated as A, B, C and D forming stable intermolecular contacts, A-B and C-D. The A-B and C-D interfaces are located on the opposite sides of the same monomer leading to the the formation of a linear chain with alternating A-B and C-D contacts. Two ligand binding sites, one at C-D contact and another at A-B contact have been observed. CPGRP-S binds to the components of bacterial cell wall molecules such as lipopolysaccharide (LPS, lipoteichoic acid (LTA, and peptidoglycan (PGN from both gram-positive and gram-negative bacteria. It also binds to fatty acids including mycolic acid of the Mycobacterium tuberculosis (Mtb. Previous structural studies of binary complexes of CPGRP-S with LPS and stearic acid (SA have shown that LPS binds to CPGRP-S at C-D contact (Site-1 while SA binds to it at the A-B contact (Site-2. The binding studies using surface plasmon resonance showed that LPS and SA bound to CPGRP-S in the presence of each other. The structure determination of the ternary complex showed that LPS and SA bound to CPGRP-S at Site-1 and Site-2 respectively. LPS formed 13 hydrogen bonds and 159 van der Waals contacts (distances ≤4.2 Å while SA formed 56 van der Waals contacts. The ELISA test showed that increased levels of productions of pro-inflammatory cytokines TNF-α and IFN-γ due to LPS and SA decreased considerably upon the addition of CPGRP-S.

  7. 三元络合碱性电沉积锌镍合金的抗腐蚀性能研究%Research on Corrosion Resistance of Ternary Complexation Alkaline Electrodeposition Zinc-nickel Alloy

    Institute of Scientific and Technical Information of China (English)

    张秀; 王少龙; 龙晋明; 裴和中; 由劲博

    2013-01-01

    The zinc-nickel alloy coating of electrodeposition preparation was made by the alkaline zinc-nickel alloy plating bath which is composed of tetraethylenepentamine (TEPA),potassium sodium tartrate and triethanolamine (TEA) ternary mixture as nickel ions complexing agent on low carbon steel substrate.The effect of different electrodeposition parameters (the current density and the relative content of nickel ions) on the corrosion electrochemical behavior of zinc-nickel alloy coating in 3.5 % NaCl solutions was investigated by polarization curve and electrochemical impedance spectroscopy.The results indicate that the coating on the substrate has an optimal protective effect when nickel content of the bath within a broad range (n (Ni2 +)/n (Ni2 + + Zn2 +) =15 %-30 %) changes.The coating corrosion resistance is the strongest when the current density within 2-3 A/dm2.However,the current density is too low and too high will decrease the corrosion resistance of the coating.%采用四乙烯五胺(TEPA)、酒石酸钾钠和三乙醇胺(TEA)三元混合物作为镍离子络合剂配制碱性锌镍合金镀液,在低碳钢基材上电沉积制备锌镍合金镀层.利用电化学工作站测试了镀层在3.5% NaCl溶液中的极化曲线和电化学阻抗谱,考察不同电沉积条件参数(电流密度和镍离子相对含量)对锌镍合金镀层的腐蚀电化学行为的影响.结果表明:当镀液的镍含量在较宽范围内(n(Ni2+)/n(Ni2+ +Zn2+) =15%~30%)变化时,所得镀层对基体都有很好的防护作用;当电流密度为2~3 A/dm2时得到的镀层抗腐蚀能力最强,而当电流密度过低和过高时都会使镀层的耐蚀性有所降低.

  8. Moessbauer studies of ternary superconductors

    Energy Technology Data Exchange (ETDEWEB)

    Kimball, C.W.; Van Landuyt, G.L.; Barnet, C.D.; Shenoy, G.K.; Dunlap, B.D.; Fradin, F.Y.

    1978-01-01

    Moessbauer studies of the ternary Chevrel phase and rare earth rhodium boride superconductors have been made. Anomalous phonon properties at the Sn site in SnMo/sub 6/S/sub 8/, SnMo/sub 6/Se/sub 8/, and La/sub 0/ /sub 98/Sn/sub 0/ /sub 02/Mo/sub 6/Se/sub 8/ have been investigated. Studies of polarization of conduction electrons at the site of the magnetic ion have been made by means of the /sup 151/Eu Moessbauer effect in Eu/sub x/Sn/sub 1-x/Mo/sub 6/S/sub 8/ and the effects of such polarization on superconducting properties discussed. The Moessbauer effect in /sup 166/Er has been used to investigate the electronic ground state in the ternary compound ErRh/sub 4/B/sub 4/ both in the superconducting and magnetically ordered states.

  9. Designing a Novel Ternary Multiplier Using CNTFET

    Directory of Open Access Journals (Sweden)

    Nooshin Azimi

    2014-11-01

    Full Text Available Today, multipliers are included as substantial keys of many systems with high efficiency such as FIR filters, microprocessors and processors of digital signals. The efficiency of the systems are mainly evaluated by their multipliers capability since multipliers are generally the slowest components of a system while occupying the most space. Multiple Valued Logic reduces the number of the required operations to implement a function and decreases the chip surface. Carbon Nanotube Field Effect Transistors (CNTFET are considered as good substitutes for Silicon Transistors (MOSFET. Combining the abilities of Carbon Nanotubes Transistors with the advantages of Multiple Valued can provide a unique design which has a higher speed and less complexity. In this paper, a new multiplier is presented by nanotechnology using a ternary logic that improves the consuming power, raises the speed and decreased the chip surface as well. The presented design is simulated using CNTFET of Stanford University and HSPICE software, and the results are compared with other instances.

  10. Some new ternary linear codes

    Directory of Open Access Journals (Sweden)

    Rumen Daskalov

    2017-07-01

    Full Text Available Let an $[n,k,d]_q$ code be a linear code of length $n$, dimension $k$ and minimum Hamming distance $d$ over $GF(q$. One of the most important problems in coding theory is to construct codes with optimal minimum distances. In this paper 22 new ternary linear codes are presented. Two of them are optimal. All new codes improve the respective lower bounds in [11].

  11. Coordination equilibria in the complex formation of guanylurea with CuII: Formation and stability of binary CuII-guanylurea and ternary CuII-guanylurea-glycinate complexes

    Indian Academy of Sciences (India)

    Tannistha Roy Barman; G N Mukherjee

    2008-07-01

    Combined pH-metric and spectrophotometric investigations on the complex formation equilibria of CuII with guanylurea (H$_{2}^{1}$NC(=O) 2NH.C(=3NH) 4NH2), hereafter, GuH, in the absence and in the presence of glycine (GlyH), in aqueous solution indicates variety of binary and mixed-ligand complexes: Cu(Gu)+, Cu(Gu)(OH); Cu(Gu)2, Cu(Gu-H)(Gu)-, Cu(Gu-H)$_{2}^{2-}$, Cu(Gu-H)(Gu-2H)3-; Cu(Gly)+, Cu(Gly) (OH); Cu(Gly)(Gu); Cu(Gly)(Gu-H)-, Cu(Gly)(Gu-2H)2-; (Gly)Cu(Gu)Cu(Gly)+, (Gly)Cu(Gu-H)Cu(Gly) and (Gly)Cu(Gu-2H)Cu(Gly)-. At pH < 6, guanylurea anion (Gu-) acts as a [(C=O), 3N-] or [=1NH, 3N-] bidentate ligand and above pH 7 it is transformed through a coordination equilibrium into a (=1N-, =3N-) bidentate ligand, similar to biguanide dianion. Occurrence of dinuclear complex species, (Gly) Cu(Gu)Cu(Gly)+, in the complexation equilibria, indicates bridging double bidentate [(1NH2, 3N-), (C=O, 4NH2)] and/or [(1NH2, 4NH2), (C=O, 3N-)] chelation by Gu- ion in an isomeric equilibrium. Above pH 6.5, the dinuclear complex decomposes mostly to the mononuclear species, Cu(Gly)(OH) and Cu(Gu)(OH) and only partly deprotonates to (Gly)Cu(Gu-H)Cu(Gly) and (Gly)Cu(Gu-2H)Cu(Gly)-. Electronic spectral shifts, with change of pH have been correlated with the possible modes of coordination of guanylurea species.

  12. Electronic structure of ternary hydrides based on light elements

    Energy Technology Data Exchange (ETDEWEB)

    Orgaz, E. [Departamento de Fisica y Quimica Teorica, Facultad de Quimica, Universidad Nacional Autonoma de Mexico, CP 04510 Coyoacan, Mexico, D.F. (Mexico)]. E-mail: orgaz@eros.pquim.unam.mx; Membrillo, A. [Departamento de Fisica y Quimica Teorica, Facultad de Quimica, Universidad Nacional Autonoma de Mexico, CP 04510 Coyoacan, Mexico, D.F. (Mexico); Castaneda, R. [Departamento de Fisica y Quimica Teorica, Facultad de Quimica, Universidad Nacional Autonoma de Mexico, CP 04510 Coyoacan, Mexico, D.F. (Mexico); Aburto, A. [Departamento de Fisica, Facultad de Ciencias, Universidad Nacional Autonoma de Mexico, CP 04510 Coyoacan, Mexico, D.F. (Mexico)

    2005-12-08

    Ternary hydrides based on light elements are interesting owing to the high available energy density. In this work we focused into the electronic structure of a series of known systems having the general formula AMH{sub 4}(A=Li,Na,M=B,Al). We computed the energy bands and the total and partial density of states using the linear-augmented plane waves method. In this report, we discuss the chemical bonding in this series of complex hydrides.

  13. Models for the Binary Complex of Bacteriophage T4 Gp59 Helicase Loading Protein. GP32 Single-Stranded DNA-Binding Protein and Ternary Complex with Pseudo-Y Junction DNA

    Energy Technology Data Exchange (ETDEWEB)

    Hinerman, Jennifer M. [Univ. of Toledo, OH (United States); Dignam, J. David [Univ. of Toledo, OH (United States); Mueser, Timothy C. [Univ. of Toledo, OH (United States)

    2012-04-05

    The bacteriophage T4 gp59 helicase assembly protein (gp59) is required for loading of gp41 replicative helicase onto DNA protected by gp32 single-stranded DNA-binding protein. The gp59 protein recognizes branched DNA structures found at replication and recombination sites. Binding of gp32 protein (full-length and deletion constructs) to gp59 protein measured by isothermal titration calorimetry demonstrates that the gp32 protein C-terminal A-domain is essential for protein-protein interaction in the absence of DNA. Sedimentation velocity experiments with gp59 protein and gp32ΔB protein (an N-terminal B-domain deletion) show that these proteins are monomers but form a 1:1 complex with a dissociation constant comparable with that determined by isothermal titration calorimetry. Small angle x-ray scattering (SAXS) studies indicate that the gp59 protein is a prolate monomer, consistent with the crystal structure and hydrodynamic properties determined from sedimentation velocity experiments. SAXS experiments also demonstrate that gp32ΔB protein is a prolate monomer with an elongated A-domain protruding from the core. Moreover, fitting structures of gp59 protein and the gp32 core into the SAXS-derived molecular envelope supports a model for the gp59 protein-gp32ΔB protein complex. Our earlier work demonstrated that gp59 protein attracts full-length gp32 protein to pseudo-Y junctions. A model of the gp59 protein-DNA complex, modified to accommodate new SAXS data for the binary complex together with mutational analysis of gp59 protein, is presented in the accompanying article (Dolezal, D., Jones, C. E., Lai, X., Brister, J. R., Mueser, T. C., Nossal, N. G., and Hinton, D. M. (2012) J. Biol. Chem. 287, 18596–18607).

  14. An Evaporation-Based Model of Thermal Neutron Induced Ternary Fission of Plutonium

    Science.gov (United States)

    Lestone, J. P.

    Ternary fission probabilities for thermal neutron induced fission of plutonium are analyzed within the framework of an evaporation-based model where the complexity of time-varying potentials, associated with the neck collapse, are included in a simplistic fashion. If the nuclear temperature at scission and the fission-neck-collapse time are assumed to be ~1.2 MeV and ~10^-22 s, respectively, then calculated relative probabilities of ternary-fission light-charged-particle emission follow the trends seen in the experimental data. The ability of this model to reproduce ternary fission probabilities spanning seven orders of magnitude for a wide range of light-particle charges and masses implies that ternary fission is caused by the coupling of an evaporation-like process with the rapid re-arrangement of the nuclear fluid following scission.

  15. An evaporation-based model of thermal neutron induced ternary fission of plutonium

    CERN Document Server

    Lestone, J P

    2007-01-01

    Ternary fission probabilities for thermal neutron induced fission of plutonium are analyzed within the framework of an evaporation-based model where the complexity of time-varying potentials, associated with the neck collapse, are included in a simplistic fashion. If the nuclear temperature at scission and the fission-neck-collapse time are assumed to be ~1.2 MeV and ~10^-22 s, respectively, then calculated relative probabilities of ternary-fission light-charged-particle emission follow the trends seen in the experimental data. The ability of this model to reproduce ternary fission probabilities spanning seven orders of magnitude for a wide range of light-particle charges and masses implies that ternary fission is caused by the coupling of an evaporation-like process with the rapid re-arrangement of the nuclear fluid following scission.

  16. Cross-linking of rabbit skeletal muscle troponin subunits: labeling of cysteine-98 of troponin C with 4-maleimidobenzophenone and analysis of products formed in the binary complex with troponin T and the ternary complex with troponins I and T.

    Science.gov (United States)

    Leszyk, J; Collins, J H; Leavis, P C; Tao, T

    1988-09-06

    The sulfhydryl-specific, heterobifunctional, photoactivatable cross-linker 4-maleimidobenzophenone (BPMal) was used to study the interaction of rabbit skeletal muscle troponin subunits TnC, TnT, and TnI. TnC was labeled at Cys-98 by the maleimide moiety of BPMal and then mixed with either TnT alone or TnI plus TnT, in the presence of Ca2+. Upon photolysis, TnI and/or TnT formed covalent cross-links with TnC. The cross-linked TnC-TnT heterodimer obtained from the binary complex was digested into progressively smaller cross-linked peptides that were purified by HPLC and then characterized by amino acid analysis and sequencing. An initial cross-linked CNBr fraction contained the expected peptide CB9 (residues 84-135) of TnC, plus CNBr peptides spanning residues 152-230 of TnT. Results from a peptic digest of the CNBr cross-linked fraction permitted the identification of residues 159-197 as the most highly cross-linked region in TnT. A final subtilisin digest yielded a heterogeneous cross-linked fraction, which suggested that an especially high degree of cross-links was formed in the vicinity of residues 175-178 (Met-Lys-Lys-Lys) of TnT. Although this region of TnT had previously been implicated in binding, we show here for the first time that it is close to Cys-98 of TnC. In an analogous study on the binary complex of TnC and TnI [Leszyk, J., Collins, J. H., Leavis, P. C., & Tao, T. (1987) Biochemistry 26, 7042-7047], we previously showed that Cys-98 of TnC was cross-linked mainly to CN4, the "inhibitory region", of TnI.(ABSTRACT TRUNCATED AT 250 WORDS)

  17. High-Efficient Circuits for Ternary Addition

    Directory of Open Access Journals (Sweden)

    Reza Faghih Mirzaee

    2014-01-01

    Full Text Available New ternary adders, which are fundamental components of ternary addition, are presented in this paper. They are on the basis of a logic style which mostly generates binary signals. Therefore, static power dissipation reaches its minimum extent. Extensive different analyses are carried out to examine how efficient the new designs are. For instance, the ternary ripple adder constructed by the proposed ternary half and full adders consumes 2.33 μW less power than the one implemented by the previous adder cells. It is almost twice faster as well. Due to their unique superior characteristics for ternary circuitry, carbon nanotube field-effect transistors are used to form the novel circuits, which are entirely suitable for practical applications.

  18. Cohesion energy calculations for ternary ionic novel crystals

    Energy Technology Data Exchange (ETDEWEB)

    Vazquez P, G.; Cabrera, E. [Instituto de Fisica, Universidad Nacional Autonoma de Mexico, A.P. 20-364, 01000 Mexico D.F. (Mexico); Mijangos, R.R. [Centro de Investigacion en Fisica, Universidad de Sonora, A.P. 5-88, 83190 Hermosillo, Sonora (Mexico); Valdez, E. [Escuela Nacional de Estudios Profesionales Acatlan, Universidad Nacional Autonoma de Mexico, Santa Cruz Acatlan, Naucalpan (Mexico); Duarte, C. [Departamento de Geologia, Universidad de Sonora, 83000 Hermosillo, Sonora (Mexico)

    2001-07-01

    The present work calculates the value of the link energy of a crystalline ternary structure newly formed by alkali halides. The ternary structure prepared with different concentrations of KCl{sub x}KBrRbCl{sub 2} maintains a very good miscibility and stability. The calculation is based on the use of a generalization of the Vegard law (which generally is valid for binary compounds) for calculating the values of the lattice constant and the repulsive m exponent. The value of the lattice parameter given by X-ray diffractometry agrees with the close approximation of the calculated value of the method used. It also compares the value of energy cohesion obtained by the Born expression with more complex approximations. (Author)

  19. Ternary structure reveals mechanism of a membrane diacylglycerol kinase

    Science.gov (United States)

    Li, Dianfan; Stansfeld, Phillip J.; Sansom, Mark S. P.; Keogh, Aaron; Vogeley, Lutz; Howe, Nicole; Lyons, Joseph A.; Aragao, David; Fromme, Petra; Fromme, Raimund; Basu, Shibom; Grotjohann, Ingo; Kupitz, Christopher; Rendek, Kimberley; Weierstall, Uwe; Zatsepin, Nadia A.; Cherezov, Vadim; Liu, Wei; Bandaru, Sateesh; English, Niall J.; Gati, Cornelius; Barty, Anton; Yefanov, Oleksandr; Chapman, Henry N.; Diederichs, Kay; Messerschmidt, Marc; Boutet, Sébastien; Williams, Garth J.; Marvin Seibert, M.; Caffrey, Martin

    2015-12-01

    Diacylglycerol kinase catalyses the ATP-dependent conversion of diacylglycerol to phosphatidic acid in the plasma membrane of Escherichia coli. The small size of this integral membrane trimer, which has 121 residues per subunit, means that available protein must be used economically to craft three catalytic and substrate-binding sites centred about the membrane/cytosol interface. How nature has accomplished this extraordinary feat is revealed here in a crystal structure of the kinase captured as a ternary complex with bound lipid substrate and an ATP analogue. Residues, identified as essential for activity by mutagenesis, decorate the active site and are rationalized by the ternary structure. The γ-phosphate of the ATP analogue is positioned for direct transfer to the primary hydroxyl of the lipid whose acyl chain is in the membrane. A catalytic mechanism for this unique enzyme is proposed. The active site architecture shows clear evidence of having arisen by convergent evolution.

  20. Comparison Of Modified Dual Ternary Indexing And Multi-Key Hashing Algorithms For Music Information Retrieval

    Directory of Open Access Journals (Sweden)

    Rajeswari Sridhar

    2010-07-01

    Full Text Available In this work we have compared two indexing algorithms that have been used to index and retrieve Carnatic music songs. We have compared a modified algorithm of the Dual ternary indexing algorithm for music indexing and retrieval with the multi-key hashing indexing algorithm proposed by us. The modification in the dual ternary algorithm was essential to handle variable length query phrase and to accommodate features specific to Carnatic music. The dual ternary indexing algorithm is adapted for Carnatic music by segmenting using the segmentation technique for Carnatic music. The dual ternary algorithm is compared with the multi-key hashing algorithm designed by us for indexing and retrieval in which features like MFCC, spectral flux, melody string and spectral centroid are used as features for indexing data into a hash table. The way in which collision resolution was handled by this hash table is different than the normal hash table approaches. It was observed that multi-key hashing based retrieval had a lesser time complexity than dual-ternary based indexing The algorithms were also compared for their precision and recall in which multi-key hashing had a better recall than modified dual ternary indexing for the sample data considered.

  1. Size-tunable supramolecular nanoparticles mediated by ternary cucurbit (8)uril host-guest interactions

    NARCIS (Netherlands)

    Stoffelen, C.; Huskens, Jurriaan

    2013-01-01

    The formation of size-tunable, supramolecular nanoparticles (SNPs), employing cucurbit[8]uril-assisted naphthol–viologen charge-transfer complexes, is strongly time and temperature dependent. Yet, the ternary complex formation is fast at all temperatures employed. This indicates that SNP formation

  2. Ternary fission and cluster radioactivities

    CERN Document Server

    Poenaru, D N; Greiner, W; Gherghescu, R A; Hamilton, J H; Ramayya, A V

    2002-01-01

    Ternary fission yield for different kinds of light particle accompanied fission processes is compared to the Q-values for the corresponding cold phenomena, showing a striking correlation. The experimental evidence for the existence of a quasimolecular state in sup 1 sup 0 Be accompanied fission of sup 2 sup 5 sup 2 Cf may be explained using a three-center phenomenological model which generates a third minimum in the deformation energy at a separation distance very close to the touching point. This model is a natural extension of the unified approach to three groups of binary decay modes (cold fission, cluster radioactivities and alpha decay), illustrated by sup 2 sup 3 sup 4 U decay modes, and the alpha valley on the potential energy surfaces of sup 1 sup 0 sup 6 Te. New measurements of cluster decay modes, confirming earlier predictions within analytical superasymmetric fission model, are included in a comprehensive half-life systematics. (authors)

  3. Synthesis of ternary nitrides by mechanochemical alloying

    DEFF Research Database (Denmark)

    Jacobsen, C.J.H.; Zhu, J.J.; Lindelov, H.;

    2002-01-01

    Ternary metal nitrides ( of general formula MxM'N-y(z)) attract considerable interest because of their special mechanical, electrical, magnetic, and catalytic properties. Usually they are prepared by ammonolysis of ternary oxides (MxM'O-y(m)) at elevated temperatures. We show that ternary...... nitrides by mechanochemical alloying of a binary transition metal nitride (MxN) with an elemental transition metal. In this way, we have been able to prepare Fe3Mo3N and Co3Mo3N by ball-milling of Mo2N with Fe and Co, respectively. The transformation sequence from the starting materials ( the binary...

  4. Realizing Ternary Logic in FPGAs for SWL DSP Systems

    Directory of Open Access Journals (Sweden)

    Tayeb Din

    2013-07-01

    Full Text Available Recently SWL (Short Word Length DSP (Digital Signal Processing applications has been proposed to overcome multiplier complexity that is evident in most of the digital applications. These SWL applications have been processed through sigma-delta modulation as a key element. For such applications, adder design plays vital role and can impact upon the chip area and its performance. In this paper, a ternary approach for adder tree has been proposed instead of binary that can accommodate more data with less chip-area at the cost of extra pin. The proposed ternary adder tree has been designed and developed in Quartus-II using three different design strategies namely T-gate (Ternary gate, LUT (Look Up Table and algebraic equations. Through rigorous simulation it was found that T-gate technique results in superior performance, an average of 23.5 and 33% improvement compared to the same adder structure based on Boolean Algebraic Equation and LUT, respectively. The proposed adder design would benefit the efficient implementation of SWL applications.

  5. CMOS Design of Ternary Arithmetic Devices

    Institute of Scientific and Technical Information of China (English)

    吴训威; F.Prosser

    1991-01-01

    This paper presents CMOS circuit designs of a ternary adder and a ternary multiplier,formulated using transmission function theory.Binary carry signals appearing in these designs allow conventional look-ahead carry techniques to be used.compared with previous similar designs,the circuits proposed in this paper have advantages such as low dissipation,low output impedance,and simplicity of construction.

  6. 水杨醛缩乙醇胺及8-羟基喹啉氧钒三元配合物的合成、晶体结构及热分解研究%Synthesis,Crystal Structure and Thermal Decomposition of Oxovanadium(V) Ternary Complex with N-salicylidene-N'-aminoethanol and 8-hydroxy Quinoline

    Institute of Scientific and Technical Information of China (English)

    李连之; 许涛; 陶绪泉; 杜茂喜; 刘颖; 杜凌云

    2004-01-01

    A new oxovanadium(V) ternary complex, VO (L) (hq) [H2L: N-salicylidene-N'-aminoethanol;hq:8-hydroxy quinoline],was synthesized by the reaction of salicyaldehyde, aminoethanol and 8-hydroxy quinoline with vanadyl sulfate.It was characterized by elemental analysis,IR and X-ray diffraction analysis.The crystal of the title complex (C18H15N2O4V,Mr=374.26) belongs to monoclinic,space group P21/n with the following crystallographic parameters:a=1.543 5(5) nm,b=0.6620(2)nm,c=1.648 9(6) nm,β=105.043(7)°,V=1.627 3(10) nm3,Z=4,Dc=1.528g.cm-3,μ(MoKa)=0.636 mm-1,F(000)=768,and final R1=0.056 8,wR2=0.106 7 for observed reflections 957(I>2σ(I)).The complex is six-coordinate in distorted octahedral geometry.The thermal decomposition for the complex was studied by TG-DTG curves and the apparent activation energy was obtained by the Kissinger formula.CCDC:218497.

  7. 氨三乙酸、缬氨酸、亮氨酸的三元过渡金属配合物:合成和生物学应用%Ternary Transition Metal Complexes of Nitrilotriacetic Acid and Valine or Leucine:Synthesis and Biological Applications

    Institute of Scientific and Technical Information of China (English)

    Mostafa M Hkhalil; Eglal R Souaya; Eman H Ismail; Eman Rabie

    2013-01-01

    Ternary complexes of Ni(Ⅱ),Cu(Ⅱ),and Zn(Ⅱ) with nitrilotriacetic acid HNTA2-as a primary ligand and valine or leucine as a secondary ligand were synthesized in slightly acidic medium.The new complexes were characterized by elemental analysis,FTIR,UV-Vis spectroscopy,thermal analysis,magnetic measurements and mass spectroscopy.The results indicate that the ternary complexes are isolated in M:HNTA:valine (or leucine) ratio of 1:1:1,and the molecular structures are suggested to be [M(HNTA)(valine)(H2O)2]· 1.5H2O and [M(HNTA) (leucine)(H2O)2]· 1.5H2O,where M=Ni(Ⅱ) or Cu(Ⅱ) and H2 [Zn(NTA)(valine)(H2O)] H2O.The suggested geometry of our ternary metal complexes is an octahedral symmetry.The antimicrobial activities of prepared complexes against Escherichia coli,Staphylococcus aureus,Candida albicans and Aspergillus flavus (isolates from Microanalytical Center,Faculty of Science,Cairo University) were also investigated.The complexes were tested in vitro to assess growth inhibitory activity against the bacterial and fungal species with standard antibacterial and antifungal agents according to the recommended known method.%以氨三乙酸HNTA2-为主要配体,缬氨酸(valine)或亮氨酸(leucine)为次要配体在微酸性介质中合成了Ni(Ⅱ),Cu(Ⅱ),and Zn(Ⅱ)的三元配合物.用元素分析、热分析、FTIR,UV-Vis分光光度法,磁性测量和质谱法表征了合成的三元配合物.结果表明,三元配合物可在金属(M)∶氨三乙酸(HNTA):缬氨酸(valine)或亮氨酸(leucine)=1∶1∶1时制得,其分子结构为[M(HNTA)(valine)(H2O)2]·1.5H2O and [M(HNTA)(leucine)(H2O)2]·1.5H2O(其中M=Ni(Ⅱ) or Cu(Ⅱ))和H2[Zn(NTA)(valine)(H2O)]H2O.标题三元过渡金属配合物为八面体对称构型.同时研究了该三元配合物对大肠杆菌,金黄色葡萄球菌,白色念珠菌,黄曲霉菌(菌株从开罗大学理学院微分析中心获得)的抗菌活性.根据推荐的知名方法用标准的抗菌和抗

  8. Density functional for ternary non-additive hard sphere mixtures.

    Science.gov (United States)

    Schmidt, Matthias

    2011-10-19

    Based on fundamental measure theory, a Helmholtz free energy density functional for three-component mixtures of hard spheres with general, non-additive interaction distances is constructed. The functional constitutes a generalization of the previously given theory for binary non-additive mixtures. The diagrammatic structure of the spatial integrals in both functionals is of star-like (or tree-like) topology. The ternary diagrams possess a higher degree of complexity than the binary diagrams. Results for partial pair correlation functions, obtained via the Ornstein-Zernike route from the second functional derivatives of the excess free energy functional, agree well with Monte Carlo simulation data. © 2011 IOP Publishing Ltd

  9. Ternary system of dihydroartemisinin with hydroxypropyl-β-cyclodextrin and lecithin: simultaneous enhancement of drug solubility and stability in aqueous solutions.

    Science.gov (United States)

    Wang, Dan; Li, Haiyan; Gu, Jingkai; Guo, Tao; Yang, Shuo; Guo, Zhen; Zhang, Xueju; Zhu, Weifeng; Zhang, Jiwen

    2013-09-01

    The purpose of this study was to simultaneously improve the solubility and stability of dihydroartemisinin (DHA) in aqueous solutions by a ternary cyclodextrin system comprised of DHA, hydroxypropyl-β-cyclodextrin (HP-β-CD) and a third auxiliary substance. Solubility and phase solubility studies were carried out to evaluate the solubilizing efficiency of HP-β-CD in association with various auxiliary substances. Then, the solid binary (DHA-HP-β-CD or DHA-lecithin) and ternary systems were prepared and characterized by Fourier transform infrared (FT-IR), differential scanning calorimetry (DSC) and power X-ray diffraction (PXRD). The effect of the ternary system on the solubility, dissolution and stability of DHA in aqueous solutions was also investigated. As a result, the soybean lecithin was found to be the most promising third component in terms of solubility enhancement. For the solid characterization, the disappearance of the drug crystallinity indicated the formation of new solid phases, implicating the formation of the ternary system. The dissolution rate of the solid ternary system was much faster than that of the drug alone and binary systems. Importantly, compared with binary systems, the ternary system showed a significant improvement in the stability of DHA in Hank's balanced salt solutions (pH 7.4). The solubility and stability of DHA in aqueous solutions were simultaneously enhanced by the ternary system, which might be attributed to the possible formation of a ternary complex. For the ternary interactions, results of molecular docking studies further indicated that the lecithin covered the top of the wide rim of HP-β-CD and surrounded around the peroxide bridging of DHA, providing the possibility for the ternary complex formation. In summary, the ternary system prepared in our study, with simultaneous enhancement of DHA solubility and stability in aqueous solutions, might have an important pharmaceutical potential in the development of a better

  10. Thermodiffusion in binary and ternary nonpolar hydrocarbon + alcohol mixtures

    Science.gov (United States)

    Eslamian, Morteza; Saghir, M. Ziad

    2012-12-01

    Thermodiffusion in complex mixtures, such as associating, molten metal, and polymer mixtures is difficult to model usually owing to the occurrence of a sign change in the thermodiffusion coefficient when the mixture concentration and temperature change. A mixture comprised of a nonpolar hydrocarbon and an alcohol is a complex and highly non-ideal mixture. In this paper an existing binary non-equilibrium thermodynamics model (Eslamian and Saghir, Physical Review E 80, 061201, 2009) developed for aqueous mixtures of alcohols is examined against the experimental data of binary nonpolar hydrocarbon and alcohol mixtures. For ternary mixtures, non-equilibrium thermodynamic expressions developed by the authors for aqueous mixtures of alcohols (Eslamian and Saghir, Canadian Journal of Chemical Engineering, DOI 10.1002/cjce.20581) is used to predict thermodiffusion coefficients of ternary nonpolar hydrocarbon and alcohol mixtures. The rationale behind the sign change is elucidated and attributed to an anomalous change in the molecular structure and therefore viscosity of such mixtures. Model predictions of thermodiffusion coefficients of binary mixtures predict a sign change consistent with the experimental data although the model is still too primitive to capture all structural complexities. For instance, in the methanol-benzene mixture where the model predictions are poorest, the viscosity data show that when concentration varies, the mixture's molecular structure experiences a severe change twice, the first major change leading to a maximum in the thermodiffusion coefficient, whereas the second change causes a sign change.

  11. The ternary sorption system U(VI)-phosphate-silica explained by spectroscopy and thermodynamic modelling

    Energy Technology Data Exchange (ETDEWEB)

    Foerstendorf, Harald; Stockmann, Madlen; Heim, Karsten; Mueller, Katharina; Brendler, Vinzenz [Helmholtz-Zentrum Dresden-Rossendorf e.V., Dresden (Germany). Surface Processes; Comarmond, M.J.; Payne, T.E. [Australian Nuclear Science and Technology Organisation, Lucas Heights (Australia); Steudtner, Robin [Helmholtz-Zentrum Dresden-Rossendorf e.V., Dresden (Germany). Inst. of Resource Ecology

    2017-06-01

    Spectroscopic data of sorption processes potentially provide direct impact on Surface Complexation Modelling (SCM) approaches. Based on spectroscopic data of the ternary sorption system U(VI)/phosphate/silica strongly suggesting the formation of a precipitate as the predominant surface process, SCM calculations accurately reproduced results from classical batch experiments.

  12. Glass transition behavior of ternary disaccharide-ethylene glycol-water solutions

    Science.gov (United States)

    Yu, Tongxu; Zhao, Lishan; Wang, Qiang; Cao, Zexian

    2017-06-01

    Glass transition behavior of ternary disaccharide-ethylene glycol-water solutions, in reference to that of the binary combinations, has been investigated towards a better understanding of their cryoprotective ability. In water-deficient solutions, the disaccharides, including trehalose, sucrose and maltose, can associate with more than 100 ethylene glycol molecules to form amorphous complex, one order of magnitude larger than the corresponding hydration numbers. In water-rich solutions, a second glass transition emerges with increasing molar fraction of ethylene glycol, indicating the possible synergy of disaccharides and ethylene glycol in vitrification of the ternary aqueous solution.

  13. Electrorheological fluid of kaolinite-based ternary nanocomposite and its properties

    Institute of Scientific and Technical Information of China (English)

    WANG; Baoxiang; ZHAO; Xiaopeng; YAO; Yuan

    2005-01-01

    According to the physical and chemical design, a kind of kaolinite /dimethylsulfoxide/carboxymethyl starch (CMS) ternary nanocomposite was prepared by the two-step composite method. Firstly, the polar liquid-dimethylsulfoxide (DMSO) was directly intercalated into the interlayer of kaolinite, and then the intercalated complex was composite with CMS by the solution method. The results showed that DMSO moderately intercalated the interlayer of kaolinite and the basal spacing of kaolinite was swollen from 0.715 to 1.120 nm. Under the electric fields of 5 kV mm-1 and volume fraction 30%, the static shear stress of kaolinite/DMSO/CMS ternary ERF could reach 17 kPa, which was 14 times and 4.25 times higher than that of pure kaolinite ERF and kaolinite/CMS ERF respectively. At the suitable component ratio (kaolinite:DMSO:CMS=1:0.75:0.6) of nanocomposite, a stronger synergetic effect and the optimum electrorheological effect could be attained. The ternary nanocomposite ERF also had good temperature effect and sedimentation properties. The sedimentation part of ternary nanocomposite ERF was only 9% after 30 days. The results of dielectric properties showed that the dielectric constant and conductivity of ternary nanocomposite ERF had been improved more enormously than that of the single component ERF and binary composite ERF. So the polarization and dielectric mismatch were strengthened, which was suitable to the enhancement of ER effect.

  14. TEM Investigations on Layered Ternary Ceramics

    Institute of Scientific and Technical Information of China (English)

    Zhijun LIN; Meishuan LI; Yanchun ZHOU

    2007-01-01

    Layered ternary ceramics represent a new class of solids that combine the merits of both metals and ceramics.These unique properties are strongly related to their layered crystal structures and microstructures. The combination of atomic-resolution Z-contrast scanning transmission electron microscopy (STEM) and transmission electron microscopy (TEM), selected area electron diffraction (SAED), convergent beam electron diffraction (CBED) represents a powerful method to link microstructures of materials to macroscopic properties, allowing layered ternary ceramics to be investigated in an unprecedented detail. Vicrostructural information obtained using TEM is useful in understanding the formation mechanism, layered stacking characteristics, and defect structures for layered ternary ceramics down to atomic-scale level; and thus provides insight into understanding the "Processing-Structure-Property" relationship of layered ternary ceramics. Transmission electron microscopic characterizations of layered ternary ceramics in Ti-Si-C, Ti-Al-C, Cr-Al-C, Zr-Al-C, Ta-Al-C and Ti-Al-N systems are reviewed.

  15. Process of electroless plating Cu-Sn-Zn ternary alloy

    Institute of Scientific and Technical Information of China (English)

    2006-01-01

    Cu-Sn-Zn ternary alloy layer with 10 μm thickness was prepared through electroless plating method. The influences of process conditions including the concentration of metallic salts, reductant and complex agent on Cu-Sn-Zn alloy were studied in details.The stability to bear color changes and corrosion resistance of Cu-Sn-Zn film layer were studied through air-exposure experiment and electrochemical analyses test respectively. The results show that the performances of Cu-Sn-Zn film layer are obviously superior to brass matrix. By use of SEM,EDS and XRD, the morphology, microstructure and chemical composition were investigated. The results show that complex agent can increase the content of Sn and Zn, improve the evenness and compactness and decrease needle holes, therefore the properties of electroless plating layer such as the stability to bear color changes and corrosion resistance are improved remarkably.The probable mechanism of complex agent was discussed.

  16. On Approximate -Ternary -Homomorphisms: A Fixed Point Approach

    Directory of Open Access Journals (Sweden)

    Cho YJ

    2011-01-01

    Full Text Available Using fixed point methods, we prove the stability and superstability of -ternary additive, quadratic, cubic, and quartic homomorphisms in -ternary rings for the functional equation , for each .

  17. Ternary fission induced by polarized neutrons

    Science.gov (United States)

    Gönnenwein, Friedrich

    2013-12-01

    Ternary fission of (e,e) U- and Pu- isotopes induced by cold polarized neutrons discloses some new facets of the process. In the so-called ROT effect shifts in the angular distributions of ternary particles relative to the fission fragments show up. In the so-called TRI effect an asymmetry in the emission of ternary particles relative to a plane formed by the fragment momentum and the spin of the neutron appear. The two effects are shown to be linked to the components of angular momentum perpendicular and parallel to the fission axis at the saddle point of fission. Based on theoretical models the spectroscopic properties of the collective transitional states at the saddle point are inferred from experiment.

  18. Elliptic curves and positive definite ternary forms

    Institute of Scientific and Technical Information of China (English)

    WANG; Xueli(

    2001-01-01

    [1]Pei Dingyi, Rosenberger, G. , Wang Xueli, The eligible numbers of positive definite ternary forms, Math. Zeitschriften,2000, 235: 479-497.[2]Wang Xueli, Pei Dingyi, Modular forms of 3/2 weight and one conjecture of Kaplansky, preprint.[3]Jones, B., The regularity of a genus of positive ternary quadratic forms, Trans. Amer. Math. Soc., 1931, 33: 111-124.[4]Kaplansky, I., The first nontrivial genus of positive definite ternary forms, Math. Comp., 1995, 64: 341-345.[5]Antoniadis, J. A., Bungert, M., Frey, G., Properties of twists of elliptic curves, J. Reine Angew Math., 1990, 405: 1-28.

  19. Laminin network formation studied by reconstitution of ternary nodes in solution.

    Science.gov (United States)

    Purvis, Alan; Hohenester, Erhard

    2012-12-28

    The polymerization of laminins into a cell-associated network is a key process in basement membrane assembly. Network formation is mediated by the homologous short arm tips of the laminin heterotrimer, each consisting of a globular laminin N-terminal (LN) domain followed by a tandem of laminin-type epidermal growth factor-like (LEa) domains. How the short arms interact in the laminin network is unclear. Here, we have addressed this question by reconstituting laminin network nodes in solution and analyzing them by size exclusion chromatography and light scattering. Recombinant LN-LEa1-4 fragments of the laminin α1, α2, α5, β1, and γ1 chains were monomeric in solution. The β1 and γ1 fragments formed the only detectable binary complex and ternary complexes of 1:1:1 stoichiometry with all α chain fragments. Ternary complex formation required calcium and did not occur at 4 °C, like the polymerization of full-length laminins. Experiments with chimeric short arm fragments demonstrated that the LEa2-4 regions of the β1 and γ1 fragments are dispensable for ternary complex formation, and an engineered glycan in the β1 LEa1 domain was also tolerated. In contrast, mutation of Ser-68 in the β1 LN domain (corresponding to a Pierson syndrome mutation in the closely related β2 chain) abolished ternary complex formation. We conclude that authentic ternary nodes of the laminin network can be reconstituted for structure-function studies.

  20. Collins Model and Phase Diagram of 2D Ternary System

    Institute of Scientific and Technical Information of China (English)

    XIE Chuan-Mei; CHEN Li-Rong

    2004-01-01

    The Collins model is introduced into the two-dimensional (2D) alternative ternary system having the Lennard-Jones (L-J) potential. The Gibbs free energy of this ternary system is calculated, and according to thermodynamic theory, a group of equations that determine the solid-liquid diagram of ternary system are derived, some isothermal sectional diagrams of the 2D ternary system are obtained. The results are quite similar to the behavior of three-dimensional substances.

  1. Ternary carbon composite films for supercapacitor applications

    Science.gov (United States)

    Tran, Minh-Hai; Jeong, Hae Kyung

    2017-09-01

    A simple, binder-free, method of making supercapacitor electrodes is introduced, based on modification of activated carbon with graphite oxide and carbon nanotubes. The three carbon precursors of different morphologies support each other to provide outstanding electrochemical performance, such as high capacitance and high energy density. The ternary carbon composite shows six times higher specific capacitance compared to that of activated carbon itself with high retention. The excellent electrochemical properties of the ternary composite attribute to the high surface area of 1933 m2 g-1 and low equivalent series resistance of 2 Ω, demonstrating that it improve the electrochemical performance for supercapacitor applications.

  2. Ternary interaction parameters in calphad solution models

    Energy Technology Data Exchange (ETDEWEB)

    Eleno, Luiz T.F., E-mail: luizeleno@usp.br [Universidade de Sao Paulo (USP), SP (Brazil). Instituto de Fisica; Schön, Claudio G., E-mail: schoen@usp.br [Universidade de Sao Paulo (USP), SP (Brazil). Computational Materials Science Laboratory. Department of Metallurgical and Materials Engineering

    2014-07-01

    For random, diluted, multicomponent solutions, the excess chemical potentials can be expanded in power series of the composition, with coefficients that are pressure- and temperature-dependent. For a binary system, this approach is equivalent to using polynomial truncated expansions, such as the Redlich-Kister series for describing integral thermodynamic quantities. For ternary systems, an equivalent expansion of the excess chemical potentials clearly justifies the inclusion of ternary interaction parameters, which arise naturally in the form of correction terms in higher-order power expansions. To demonstrate this, we carry out truncated polynomial expansions of the excess chemical potential up to the sixth power of the composition variables. (author)

  3. 新型双β-二酮、邻菲罗啉和铕(Ⅲ)三元配合物的合成与发光%Synthesis, Luminescent Properties of New Ternary Complex of Eu3 + with Bis (β-diketone) and 1,10-phenanthroline

    Institute of Scientific and Technical Information of China (English)

    刘万云; 霍平; 伍晓春; 梅光泉

    2011-01-01

    A new ternary complex of Eu3 + with bis ( β-diketone ) ligand 1,3-bis [3- (2-thiophenyl) -3-oxopropan-oyl]benzene and 1,10-phenanthroline was synthesized. The properties of this complex were characterized by IR , UV-Visible spectrometry, elemental analysis and TG-DSC. The photoluminescence of complex indicated that there is a sharp and strong red emission peak at 612 nm attributed to 5D0→7F2 transition of Eu3+ ion. The results showed that this Eu3+ -bis(β-diketone) complex would be a potential excellent red emission material.%合成了一个新型双β-二酮有机配体1,3-双[3-(2-噻吩基)-3-氧代丙酰基]苯、邻菲罗啉和铕的三元配合物,并应用红外光谱、紫外-可见光谱、元素分析和热重-差热分析等对配合物进行了组成确定和结构表征.荧光分析结果表明,配合物612 nm处的发射光谱为中心离子Eu3+的特征红光,属5D0→7F2跃迁带,峰形尖锐,单色性好,表明该固体铕双β-二酮配合物是一种潜在的红色发光材料.

  4. Issues Affecting the Synthetic Scalability of Ternary Metal Ferrite Nanoparticles

    Directory of Open Access Journals (Sweden)

    Lauren Morrow

    2015-01-01

    Full Text Available Ternary Mn-Zn ferrite (MnxZn1-xFe2O4 nanoparticles (NPs have been prepared by the thermal decomposition of an oleate complex, sodium dodecylbenzenesulfonate (SDBS mediated hydrazine decomposition of the chloride salts, and triethylene glycol (TREG mediated thermal decomposition of the metal acetylacetonates. Only the first method was found to facilitate the synthesis of uniform, isolable NPs with the correct Mn : Zn ratio (0.7 : 0.3 as characterized by small angle X-ray scattering (SAXS, transmission electron microscopy (TEM, and inductively coupled plasma-optical emission spectroscopy (ICP-OES. Scaling allowed for retention of the composition and size; however, attempts to prepare Zn-rich ferrites did not result in NP formation. Thermogravimetric analysis (TGA indicated that the incomplete decomposition of the metal-oleate complexes prior to NP nucleation for Zn-rich compositions is the cause.

  5. Solid-liquid equilibria in the ternary system NaBr-KBr-H2O at 398 K

    Science.gov (United States)

    Cui, Rui-Zhi; Zhang, Ting-Ting; Wang, Wei; Sang, Shi-Hua

    2017-09-01

    The solubilities of the ternary system NaBr-KBr-H2O were investigated by isothermal method at 398 K. On the basis of the experimental data, the phase diagram was plotted. In the phase diagram of ternary system NaBr-KBr-H2O at 398 K, no complex salt or solid solution was found. It belongs to simple co-saturation type. There are only one invariant point, two univariant curves, and two crystallization fields corresponding to NaBr and KBr. Using the equilibrium solubilities data of the ternary system at 398 K, mixing ioninteraction parameter ΨNa,K,Br of Pitzer's equation was fitted by multiple linear regression method. Based on the Pitzer model and its extended Harvie-Weare (HW) model, the solubilities of phase equilibrium in the ternary system NaBr-KBr-H2O at 398 K were calculated. The phase diagram of the ternary system was plotted. The results show that calculated values have a good agreement with measured experimental data. It can demonstrate the accuracy of the experimental data, and it also shows that reasonable parameters of the Pitzer model can be used in ternary system NaBr-KBr-H2O at 398 K.

  6. Hydrogen bonds determine the structures of the ternary heterocyclic complexes C₂H₄O···2HF, C₂H₅N···2HF and C₂H₄S···2HF: density functional theory and topological calculations.

    Science.gov (United States)

    Oliveira, Boaz G; Araújo, Regiane C M U; Carvalho, Antônio B; Ramos, Mozart N

    2011-11-01

    A theoretical study of structural, electronic, topological and vibrational parameters of the ternary hydrogen-bonded complexes C(2)H(4)O···2HF, C(2)H(5)N···2HF and C(2)H(4)S···2HF is presented here. Different from binary systems with a single proton donor, the tricomplexes have the property of forming multiple hydrogen bonds, which are analyzed from a structural and vibrational point of view, but verified only by means of the quantum theory of atoms in molecules (QTAIM). As traditionally done in the hydrogen bond theory, the charge transfer between proton donors and acceptors was computed using the CHELPG calculations, which also revealed agreement with dipole moment variation and a cooperative effect on the tricomplexes. Furthermore, redshift events on proton donor bonds were satisfactorily identified, although, in this case, an absence of experimental data led to the use of a theoretical argument to interpret these spectroscopic shifts. It was therefore the use of the QTAIM parameters that enabled all intermolecular vibrational modes to be validated. The most stable tricomplex in terms of energy was identified via the strength of the hydrogen bonds, which were modeled as directional and bifurcated.

  7. Binding Energy Calculations for Novel Ternary Ionic Lattices

    Science.gov (United States)

    Rodríguez-Mijangos, Ricardo; Vazquez-Polo, Gustavo

    2002-03-01

    Theoretical calculations for the binding energy between metalic ions and negative ions on a novel ternary ionic lattice is carried out for several solid solutions prepared with different concentrations and characterized recently (1). The ternary lattices that reach a good miscibility are: KCl(x)KBr(y)RbCl(z) in three different concentrations: (x=y=z=0.33), (x=0.5, y=0.25, z=0.25) and (x=0.33, y=0.07, z=0.60). The binding energy for these novel structures is calculated from the lattice constants obtained by X ray diffractometry analysis performed on the samples and the Vegard law (2). For the repulsive force exponent m, an average of the m values was considered. The energy values obtained by the Born´expression are compared with corresponding energy values from the lattice with more complex expressions, such as the Born Mayer, Born-Van der Walls. There is a good aggreement between all these calculations. (1)R. R. Mijangos, A. Cordero-Borboa, E. Alvarez, M. Cervantes, Physics Letters A 282 (2001) 195-200. (2) G. Vazquez-Polo, R. R. Mijangos et al. Revista Mexicana de Fisica, 47, Diciembre 2001. In Press.

  8. Ternary geochemical-tracing system in natural gas accumulation

    Institute of Scientific and Technical Information of China (English)

    2007-01-01

    The establishment of geochemical-tracing system of gas generation and accumulation is helpful to re-elucidating the gas migration and accumulation in time and space. To deduce the complex process of gas accumulation, a ternary geochemical-tracing system is set up, according to stable isotope inheritance of source rocks, kinetic fractionation of stable isotopes, time-accumulating effect of noble gas isotopes, mantle-derived volatile inheritance, and organic molecule inheritance of light hydrocarbons and thermally kinetic fractionation in their generation, in combination with the previous achievements of gas geochemistry and geochemical parameters of gas-source correlation. There are tight interactions for the geochemical parameters with much information about parent inheritance and special biomarkers, in which they are confirmed each other, reciprocally associated and preferentially used for the requirement so that we can use these geochemical parameters to effectively demonstrate the sources of natural gas, sedimentary environments and thermal evolution of source rocks, migration and accumulation of natural gas, and rearrangement of natural gas reservoirs. It is necessary for the ternary geochemical-tracing system to predict the formation of high efficient gas reservoir and their distribution in time and space.

  9. Determination of Enthalpy Change of Reaction of Formation,Molar Heat Capacity and Constant-Volume Combustion Energy of the Ternary Solid Complex Lu(Et2dtc)3(phen)%Lu(Et2dtc)3(phen)的生成反应焓变、摩尔热容和恒容燃烧能测定

    Institute of Scientific and Technical Information of China (English)

    葛红光; 陈三平; 谢钢; 扬旭武; 高胜利; 史启祯

    2006-01-01

    A ternary solid complex Lu(Et2dtc)3(phen) has been obtained from the reaction of hydrated lutetiumchloride with sodium diethyldithiocarbamate (NaEt2dtc), and 1,10-phenanthroline (o-phen·H2O) in absolute ethanol. IR spectrum of the complex indicates that Lu3+ binds with sulfur atom in the Na (Et2dtc)3 and nitrogen atom in the o-phen. The enthalpy change of liquid-phase reaction of formation of the complex, △rHm(-)(1), was determined to be (-32.821 ± 0.147 ) Kj·mol-1 at 298.15 K by an RD-496 Ⅲ type heat conduction microcalormeter. The enthalpy change of the solid-phase reaction of formation of the complex, △rHm(-) (s), was calculated to be (104.160 ± 0.168) Kj · mol-1 on the basis of an appropriate thermochemistry cycle. The thermodynamics of liquid-phase reaction of formation of the complex was investigated by changing the temperature of liquid-phase reaction. Fundamental parameters, such as the activation enthalpy (△H(-)≠), the activation entropy (△S(-)≠), the activation free energy (△G≠(-)), the apparent reaction rate constant (k), the apparent activation energy (E), the pre-exponential constant (A) and the reaction order (n), were obtained by combination the reaction thermodynamic and kinetic equations with the data of thermokinetic experiments. The molar heat capacity of the complex, cm, was determined to be (82.23 ± 1.47) J·mol-1·K-1 by the same microcalormeter. The constant-volume combustion energy of the complex, △Cu, was determined as (-17 898.228 ± 8.59) Kj·mol-1 by an RBC-Ⅱ type rotating-bomb calorimeter at 298.15 K. Its standard enthalpy of combustion, △cHm(-), and standard enthalpy of formation, △fHm(-), were calculated to be (-17 917.43 ± 8.11) Kj·mol-1 and (-859.95 ±10.12) Kj·mol-1, respectively.

  10. Design of a novel quantum reversible ternary up-counter

    Science.gov (United States)

    Houshmand, Pouran; Haghparast, Majid

    2015-08-01

    Reversible logic has been recently considered as an interesting and important issue in designing combinational and sequential circuits. The combination of reversible logic and multi-valued logic can improve power dissipation, time and space utilization rate of designed circuits. Only few works have been reported about sequential reversible circuits and almost there are no paper exhibited about quantum ternary reversible counter. In this paper, first we designed 2-qutrit and 3-qutrit quantum reversible ternary up-counters using quantum ternary reversible T-flip-flop and quantum reversible ternary gates. Then we proposed generalized quantum reversible ternary n-qutrit up-counter. We also introduced a new approach for designing any type of n-qutrit ternary and reversible counter. According to the results, we can conclude that applying second approach quantum reversible ternary up-counter is better than the others.

  11. DESIGN OF TERNARY COUNTER BASED ON ADIABATIC DOMINO CIRCUIT

    Institute of Scientific and Technical Information of China (English)

    Yang Qiankun; Wang Pengjun; Zheng Xuesong

    2013-01-01

    By researching the ternary counter and low power circuit design method,a novel design of low power ternary Domino counter on switch-level is proposed.Firstly,the switch-level structure expression of ternary loop operation circuit with enable pin is derived according to the switch-signal theory,and the one bit ternary counter is obtained combining the ternary adiabatic Domino literal operation circuit and buffer.Then the switch-level structure expression of enable signal circuit is derived,and the four bits ternary counter is obtained by cascade connection.Finally,the circuit is simulated by Spice tool and the output waveforms transform in proper order indicating that the logic function is correct.The energy consumption of the four bits ternary adiabatic Domino counter is 63% less than the conventional Domino counterpart.

  12. Crystal structures of Two Potential Tumor Imaging Agents and Therapeutic Agents-Copper(II)Ternary Complexes With Salicylidene-tyrosinato Schiff Base and Nitrogen-donor Chelating Lewis Base

    Institute of Scientific and Technical Information of China (English)

    Ming Zhao WANG; Guan Liang CAI; Ling XIA; Jun Jian YAO; Hong Yan CHEN; Zhao Xing MENG; Bo Li LIU

    2004-01-01

    The crystal structures of two potential tumor imaging agents and therapeutic agents -copper(II) complexes with salicylidene-tyrosinato Schiff base and nitrogen-donor chelating Lewis base,[Cu(sal-tyr)(bipy)] 1 and [Cu(sal-tyr)(phen)]·2CH3OH 2, are presented. Our work is helpful to get deep understanding of novel 64Cu tumor imaging agents and therapeutic agents.

  13. Synthesis and luminescence properties of ternary europium(Ⅲ) complex with 2-thiopheneglyoxylic acid and bathophenanthroline%铕(Ⅲ)-2-噻吩乙醛酸-红菲绕啉三元配合物的合成及发光性质

    Institute of Scientific and Technical Information of China (English)

    李培杰; 胡丽; 杜凯; 尹强; 周静

    2015-01-01

    以2‐噻吩乙醛酸(HL)为第一配体,红菲绕啉(Bath)为第二配体合成了一种新型Eu(Ⅲ)三元配合物.采用等离子体原子发射光谱(ICP)、元素分析、FT‐IR和1 H NMR表征了配合物的组成及结构.通过热重(TG)和发光光谱研究了配合物的热稳定性与发光性能.结果表明,该配合物分子式为EuL3 Bath・2H2 O ,具有良好的热稳定性.在最佳激发波长(270 nm )的紫外光照射下,该配合物能发出Eu (Ⅲ)离子很强的特征红光,其中电偶极跃迁(5 D0→7 F2,613 nm )发射最强;此外,该配合物还表现出相对较长的衰减寿命(τ=11.7 m s ).%A novel ternary europium complex was synthesized with the first ligand of 2‐thio‐pheneglyoxylic (HL) and the secondary one of bathophenanthroline (Bath) .Its composition and structure were characterized by means of inductively coupled plasma atomic emission spec‐trometer (ICP) ,elemental analysis ,FT‐IR and 1 H NMR .The thermostability and lumines‐cence properties of the complex were investigated by TG and emission spectrum .The results indicates that the complex have the molecular formula EuL3 Bath・2H2 O and show s good ther‐mostability .Meanwhile ,the complex can emit strong red light under irradiation at the optimal excitation wavelength (270 nm) .Among them ,the strongest emission band of Eu(Ⅲ) at 613 nm belongs to electric dipole transition (5 D0 → 7 F2 ) .In addition ,the complex possesses com‐paratively longer decay lifetime (τ= 1 1.7 ms) .

  14. Superconducting state parameters of ternary metallic glasses

    Indian Academy of Sciences (India)

    Aditya M Vora

    2011-12-01

    The well-known empty core (EMC) model potential of Ashcroft was used to study the theoretical investigation of the superconducting state parameters (SSP) viz. electron–phonon coupling strength , Coulomb pseudopotential $\\mu^{\\ast}$, transition temperature $T_{C}$, isotope effect exponent and effective interaction strength $N_{O}V$ of some ternary metallic glasses. Most recent local field correction function due to Sarkar et al is used to study the screening influence on the aforesaid properties. Quadratic $T_{C}$ equations have been proposed and found successful. Also, the present findings are found to be in qualitative agreement with other such earlier reported data, which confirms the superconducting phase in the ternary superconductors. The pseudo-alloy-atom (PAA) model was applied for the first time instead of Vegard’s law.

  15. Comparison Of Modified Dual Ternary Indexing And Multi-Key Hashing Algorithms For Music Information Retrieval

    Directory of Open Access Journals (Sweden)

    Rajeswari Sridhar

    2010-07-01

    Full Text Available In this work we have compared two indexing algorithms that have been used to index and retrieveCarnatic music songs. We have compared a modified algorithm of the Dual ternary indexing algorithmfor music indexing and retrieval with the multi-key hashing indexing algorithm proposed by us. Themodification in the dual ternary algorithm was essential to handle variable length query phrase and toaccommodate features specific to Carnatic music. The dual ternary indexing algorithm is adapted forCarnatic music by segmenting using the segmentation technique for Carnatic music. The dual ternaryalgorithm is compared with the multi-key hashing algorithm designed by us for indexing and retrieval inwhich features like MFCC, spectral flux, melody string and spectral centroid are used as features forindexing data into a hash table. The way in which collision resolution was handled by this hash table isdifferent than the normal hash table approaches. It was observed that multi-key hashing based retrievalhad a lesser time complexity than dual-ternary based indexing The algorithms were also compared fortheir precision and recall in which multi-key hashing had a better recall than modified dual ternaryindexing for the sample data considered.

  16. 含有碘代酪氨酸的铜(Ⅱ)三元混配配合物的圆二色光谱研究——碘对甲状腺激素生物活性的结构作用探索%Circular Dichroism Study on Ternary Copper(Ⅱ) Complexes with Diiodotyrosinate-An Approach for Structural Effects of Iodines on Biological Activation of Thyroid Hormones

    Institute of Scientific and Technical Information of China (English)

    刘晓瀛; 张锋

    2001-01-01

    Absorption and circular dichroism (CD) spectra of the ternary copper(Ⅱ) complexes with 3-iodo-L-tyrosine (L-Ityr),L-tyrosine (L-Tyr),or L-homoserine (L-Hser) and amino acids L-AA,where AA represents arginine (Arg),lysine (Lys),asparagine (Asn),glutamine (Gln),or alanine (Ala),have been determined in the d-d region in various ionic strength ( I = 1.0 or 0.1 mol/L KNO3) and solvents (H2O,50% ethanol-H2O,or 50% dioxane-H2O).CD spectra for all the ternary complexes exhibit a maximum at 587~627 nm,and the △ε for Cu(L-Ityr) (L-Arg) and Cu(L-Ityr) (L-Lys) are abnormally negative (-0.479~-0.884).The △ε for Cu(L-Ityr) (L-AA) is obviously more negative than that for Cu(L-Tyr)(L-AA).The possible ligand-ligand interactions in these ternary complexes were discussed,and a structural effect of iodine on the interaction was emphasized.%用圆二色光谱法研究了铜(Ⅱ)与3-碘基-L-酪氨酸(L-Ityr),L-酪氨酸(L-Tyr),或L-高丝氨酸(L-Hser)和L-AA(AA代表精氨酸(Arg),赖氨酸(Lys),天冬酰胺(Asn),谷氨酰胺(Gln),或丙氨酸(Ala)三元混配配合物体系在不同离子强度(I=1.0或0.1mol/L KNO3)和溶剂环境(水,50%(v/v)乙醇-水或50%(v/v)二氧六环-水)条件下配体间相互作用.全部混配配合物体系的圆二色光谱在587~627nm范围均有负的极大吸收,且Cu(L-Ityr)L-Arg)和Cu(L-Ityr)(L-Lys)体系的△ε异常负(-0.479~-0.884);Cu(L-Ityr)(L-AA)体系的△ε明显比Cu(L-Tyr)(L-AA)负.讨论了这些混配配合物中配体间相互作用的规律和碘的结构效应.

  17. Ternary rare earth-lanthanide sulfides

    Science.gov (United States)

    Takeshita, Takuo; Gschneidner, Jr., Karl A.; Beaudry, Bernard J.

    1987-01-06

    A new ternary rare earth sulfur compound having the formula: La.sub.3-x M.sub.x S.sub.4 where M is a rare earth element selected from the group europium, samarium and ytterbium and x=0.15 to 0.8. The compound has good high-temperature thermoelectric properties and exhibits long-term structural stability up to 1000.degree. C.

  18. (2-(4'-噻唑基)苯并咪唑)(L-丙氨酸根)铜(Ⅱ)配合物的合成、表征、抑菌活性及与DNA的作用%Synthesis, Characterization, Antibacterial Activities and DNA Interaction of Ternary Copper(Ⅱ) Complex with 2-(4'-Thiazolyl) Benzimidazole and L-Alaninate

    Institute of Scientific and Technical Information of China (English)

    朱丽; 卢艳梅; 区志镔; 乐学义

    2012-01-01

    合成了新的三元铜(Ⅱ)配合物:[Cu(TBZ)(L-Ala)(H2O)] ClO4[其中,TBZ =2-(4'-噻唑基)苯并咪唑,L-Ala=L-丙氨酸根].通过元素分析、摩尔电导率、红外光谱及电子吸收光谱对该配合物进行了表征.用试管二倍稀释法研究了配合物的抗菌活性,发现配合物对金黄色葡萄球菌Staphylococcus aureus(C+)、枯草杆菌Bacillus subtilis(G+)、沙门氏杆菌Salmonella typhi(G-)和大肠埃希菌Escherichia coil(G-)具有良好的抑制作用.另外,采用电子吸收光谱、荧光光谱、圆二色光谱、粘度测定及琼脂凝胶电泳方法研究了配合物与小牛胸腺DNA(CT-DNA)的作用.结果表明,配合物可能以插入方式与CT-DNA作用,在维生素C存在下通过羟自由基(·OH),单线态氧(1O2)或者1O2类似物切割pBR322 DNA双螺旋结构.%A new ternary copper( II ) complex; [Cu(TBZ) ( L- Ala) ( H2 O) ] C1O4 [ TBZ = 2-(4'-thia-zolyl) benzimidazole, L-Ala = L-alaninate] , was synthesized and characterized by elemental analysis, molar conductivity, infrared absorption spectrum, and electronic absorption spectrum. The complex was assayed against gram-positive ( Staphylococcus aureus, Bacillus subtilis ) and gram-negative ( Salmonella typhi, Escherichia coil) bacteria by double dilution method, and the interaction of the complex to DNA was investigated by electronic absorption spectrometry, fluorescence spectrometry, CD spectrometry, viscosity measurement and agarose gel electrophoresis. The results indicated that the complex had good antibacterial activity, which could be bound to CT-DNA ( calf thymus DNA) by intercalative mode, cleave pBR322 DNA in the presence of vitamin C in the involvement of the hydroxyl radical, and possibly singlet oxygen.

  19. Identification of a novel polyfluorinated compound as a lead to inhibit the human enzymes aldose reductase and AKR1B10: structure determination of both ternary complexes and implications for drug design.

    Science.gov (United States)

    Cousido-Siah, Alexandra; Ruiz, Francesc X; Mitschler, André; Porté, Sergio; de Lera, Ángel R; Martín, María J; Manzanaro, Sonia; de la Fuente, Jesús A; Terwesten, Felix; Betz, Michael; Klebe, Gerhard; Farrés, Jaume; Parés, Xavier; Podjarny, Alberto

    2014-03-01

    Aldo-keto reductases (AKRs) are mostly monomeric enzymes which fold into a highly conserved (α/β)8 barrel, while their substrate specificity and inhibitor selectivity are determined by interaction with residues located in three highly variable external loops. The closely related human enzymes aldose reductase (AR or AKR1B1) and AKR1B10 are of biomedical interest because of their involvement in secondary diabetic complications (AR) and in cancer, e.g. hepatocellular carcinoma and smoking-related lung cancer (AKR1B10). After characterization of the IC50 values of both AKRs with a series of polyhalogenated compounds, 2,2',3,3',5,5',6,6'-octafluoro-4,4'-biphenyldiol (JF0064) was identified as a lead inhibitor of both enzymes with a new scaffold (a 1,1'-biphenyl-4,4'-diol). An ultrahigh-resolution X-ray structure of the AR-NADP(+)-JF0064 complex has been determined at 0.85 Å resolution, allowing it to be observed that JF0064 interacts with the catalytic residue Tyr48 through a negatively charged hydroxyl group (i.e. the acidic phenol). The non-competitive inhibition pattern observed for JF0064 with both enzymes suggests that this acidic hydroxyl group is also present in the case of AKR1B10. Moreover, the combination of surface lysine methylation and the introduction of K125R and V301L mutations enabled the determination of the X-ray crystallographic structure of the corresponding AKR1B10-NADP(+)-JF0064 complex. Comparison of the two structures has unveiled some important hints for subsequent structure-based drug-design efforts.

  20. Extraction separation of germanium with potassium iodide-1-propanol-germanium(Ⅳ)ternary complex%碘化钾-正丙醇-锗(Ⅳ)三元缔合物萃取分离锗

    Institute of Scientific and Technical Information of China (English)

    韩金土; 司学芝; 张会杰; 马万山

    2012-01-01

    The extraction and separation behaviors of germanium by potassium iodide - 1-propanol -germanium (Ⅳ) complex and the separation conditions of some metal ions were studied. The results showed that sodium chloride could separate the 1-propanol aqueous solution into two phases. In phase separation process, the complex[GeI6,2- ][C3H7OH2+]2 formed from GeI6,2- (which was generated from germanium(Ⅳ) and potassium iodide) and protonized 1-propanol (C3H7OH2,+) could be fully extracted by 1-propanol phase. The extraction rate of germanium(Ⅳ) was higher than 98. 4% when the concentrations of 1-propanol,potassium iodide and sodium chloride were 30%(V/V) ,8. 0 × 10-3 mol/L and 0. 20 g/mL,respectively. Meanwhile,Zn2+ ,Fe2+ ,Mg2+ ,Ni2+ ,Co2+ ,Mn2+ ,Ag+ , Al3+ and Cr3+ could not be extracted,realizing the separation of germanium(Ⅳ) from these metal ions.%探讨了碘化钾-正丙醇-锗(Ⅳ)三元缔合物萃取分离锗的行为及与一些金属离子分离的条件.结果表明,氯化钠能将正丙醇的水溶液分成两相,在分相过程中,Ge(Ⅳ)与碘化钾生成的GeI62-与质子化正丙醇(C3H7OH2+)形成的缔合物[GeI62-][C3H7OH2+]2能被正丙醇相完全萃取.当正丙醇、碘化钾和氯化钠的浓度分别为30%(V/V)、8.0×10-3 mol/L、0.20 g/mL时,Ge(Ⅳ)的萃取率达到98.4%以上,Zn2+、Fe2+、Mg2+、Ni2+、Co2+、Mn2+、Ag+、Al3+和Cr3+基本不被萃取,实现了Ge(Ⅳ)与上述金属离子的分离.

  1. Ternary q-Virasoro-Witt Hom-Nambu-Lie algebras

    Energy Technology Data Exchange (ETDEWEB)

    Ammar, F [Faculte des Sciences, Universite de Sfax, BP 1171, 3000 Sfax (Tunisia); Makhlouf, A [Laboratoire de Mathematiques, Informatique et Applications, Universite de Haute Alsace, 4, rue des Freres Lumiere F-68093 Mulhouse (France); Silvestrov, S, E-mail: Faouzi.Ammar@rnn.fss.t, E-mail: Abdenacer.Makhlouf@uha.f, E-mail: sergei.silvestrov@math.lth.s [Centre for Mathematical Sciences, Lund University, Box 118, SE-221 00 Lund (Sweden)

    2010-07-02

    In this paper we construct ternary q-Virasoro-Witt algebras which q-deform the ternary Virasoro-Witt algebras constructed by Curtright, Fairlie and Zachos using su(1, 1) enveloping algebra techniques. The ternary Virasoro-Witt algebras constructed by Curtright, Fairlie and Zachos depend on a parameter and are not Nambu-Lie algebras for all but finitely many values of this parameter. For the parameter values for which the ternary Virasoro-Witt algebras are Nambu-Lie, the corresponding ternary q-Virasoro-Witt algebras constructed in this paper are also Hom-Nambu-Lie because they are obtained from the ternary Nambu-Lie algebras using the composition method. For other parameter values this composition method does not yield a Hom-Nambu-Lie algebra structure for q-Virasoro-Witt algebras. We show however, using a different construction, that the ternary Virasoro-Witt algebras of Curtright, Fairlie and Zachos, as well as the general ternary q-Virasoro-Witt algebras we construct, carry a structure of the ternary Hom-Nambu-Lie algebra for all values of the involved parameters.

  2. Atomistic simulation of defect structure in ternary intermetallics

    Energy Technology Data Exchange (ETDEWEB)

    Jones, C.C.; Ternes, J.K.; Farkas, D. [Virginia Polytechnic Inst. and State Univ., Blacksburg, VA (United States). Dept. of Materials Science and Engineering

    1995-08-01

    Interatomic potentials of the Embedded Atom type were used to study defect structure in ternary intermetallics. Interatomic potentials with appropriate inner consistency were developed for the modeling of ternary systems. Alloys were considered in the Nb-Al-Ti and in the Ni-Al-Ti systems. The stability of ternary phases in these systems was studied, particularly the B2 phase in Nb rich alloys of the Nb-Al-Ti system. The effects of increasing Ti additions in these alloys were studied, as well as the APB energies in these ternary alloys.

  3. Ternary Pt-Ru-Ni catalytic layers for methanol electrooxidation prepared by electrodeposition and galvanic replacement

    OpenAIRE

    Athanasios ePapaderakis; Nikolaos ePliatsikas; Chara eProchaska; Kalliopi M. Papazisi; Balomenou, Stella P.; Dimitrios eTsiplakides; Panagiotis ePatsalas; Sotiris eSotiropoulos

    2014-01-01

    Ternary Pt-Ru-Ni deposits on glassy carbon substrates, Pt-Ru(Ni)/GC, have been formed by initial electrodeposition of Ni layers onto glassy carbon electrodes, followed by their partial exchange for Pt and Ru, upon their immersion into equimolar solutions containing complex ions of the precious metals. The overall morphology and composition of the deposits has been studied by SEM microscopy and EDS spectroscopy. Continuous but nodular films have been confirmed, with a Pt ÷ Ru ÷ Ni % bulk atomi...

  4. Spectrofluorometric determination of vanadium based on the formation of a ternary complex between vanadium, peroxides, and 2-alpha-pyridylthioquinaldinamide. Application to the determination of hydrogen peroxide and peroxy acids.

    Science.gov (United States)

    Paleologos, E K; Giokas, D L; Tzouwara-Karayanni, S M; Karayannis, M I

    2002-01-01

    A selective and sensitive method for the determination of the total amount of vanadium in nutritional and biological substrates is proposed. The method is based on the reaction of vanadium with 2-alpha-pyridylthioquinaldinamide (PTQA) in the presence of H2O2. The product of this reaction emits constant fluorescence, in a sulfuric acid environment, at 490 nm, with the exciting radiation set at 340 nm. Various parameters such as acidity, flow rate, solvents, and temperature were studied. The presence of a surface-active agent was also considered in order to increase sensitivity. At the optimal conditions, a calibration curve was constructed, revealing a linear range of 2-100 microg L(-1) and a detection limit as low as 0.5 microg L(-1) while the RSD ranged in the area of 0.1-1.8%, depending on vanadium concentration. The method was successfully applied to the analysis of a wide variety of food samples, which are known to contribute to the dietary required amount of vanadium and to relevant biological matrixes. Reversing the conditions of the above reaction, the effect of the peroxy group on the vanadium-PTQA system was examined. The formation of a vanadyl complex was revealed which was suitable for the determination of hydrogen peroxide and peroxy acids. Linear calibration curves in the range of 0.2-50 microM for H2O2 and 0.1-2 microM for a respective peroxy acid were obtained, yielding detection limits of 0.05 and 0.03 microM, respectively.

  5. Preparation and Luminescence Properties of Ternary Europium Complexes In-Situ Synthesized in Silica/Polymer Hybrid Matrix by a Two-Step Sol-Gel Process%两步溶胶-凝胶法于SiO2/聚合物杂化基质中原位合成铕的三元配合物及其发光性质

    Institute of Scientific and Technical Information of China (English)

    符连社; 张洪杰; 王淑彬; 孟庆国; 杨魁跃; 倪嘉缵

    1999-01-01

    采用两步溶胶-凝胶过程制备了含铕的三元配合物的凝胶.荧光激发光谱证实于SiO2基质中原位合成了铕的配合物.含铕配合物的杂化材料发出铕的特征荧光,与相应的纯配合物溶于乙醇相比,铕离子具有较长的荧光寿命.%The gels containing ternary europium complexes have been prepared by a two-step sol-gel method.Europium complexes are in-situ synthesized in sol-gel derived silica/poly(hydroxyethyl methacrylate) matrix,and confirmed by the luminescence excitation spectrum.The hybrid materials that contain europium complexes exhibit the characteristic emission bands of Eu3+ and present longer fluorescence lifetimes than the corresponding complexes powder dissolved in ethanol solution.

  6. Preferential selection of isomer binding from chiral mixtures: alternate binding modes observed for the E and Z isomers of a series of 5-substituted 2,4-diaminofuro[2,3-d]pyrimidines as ternary complexes with NADPH and human dihydrofolate reductase

    Energy Technology Data Exchange (ETDEWEB)

    Cody, Vivian, E-mail: cody@hwi.buffalo.edu [Structural Biology Department, Hauptman-Woodward Medical Research Institute, 700 Ellicott Street, Buffalo, NY 14203 (United States); University of Buffalo, 700 Ellicott Street, Buffalo, NY 14203 (United States); Piraino, Jennifer; Pace, Jim [Structural Biology Department, Hauptman-Woodward Medical Research Institute, 700 Ellicott Street, Buffalo, NY 14203 (United States); Li, Wei; Gangjee, Aleem [Graduate Division, Medicinal Chemistry, Duquesne University, Pittsburgh, PA 15213 (United States); Structural Biology Department, Hauptman-Woodward Medical Research Institute, 700 Ellicott Street, Buffalo, NY 14203 (United States)

    2010-12-01

    The structures of six chirally mixed E/Z-isomers of 5-substituted 2,4-diaminofuro[2,3-d]pyrimidines reveals only one isomer is bound in the active site of human DHFR. The configuration of all but one C9-analogue is observed as the E-isomer. The crystal structures of six human dihydrofolate reductase (hDHFR) ternary complexes with NADPH and a series of mixed E/Z isomers of 5-substituted 5-[2-(2-methoxyphenyl)-prop-1-en-1-yl]furo[2,3-d]pyrimidine-2,4-diamines substituted at the C9 position with propyl, isopropyl, cyclopropyl, butyl, isobutyl and sec-butyl (E2–E7, Z3) were determined and the results were compared with the resolved E and Z isomers of the C9-methyl parent compound. The configuration of all of the inhibitors, save one, was observed as the E isomer, in which the binding of the furopyrimidine ring is flipped such that the 4-amino group binds in the 4-oxo site of folate. The Z3 isomer of the C9-isopropyl analog has the normal 2,4-diaminopyrimidine ring binding geometry, with the furo oxygen near Glu30 and the 4-amino group interacting near the cofactor nicotinamide ring. Electron-density maps for these structures revealed the binding of only one isomer to hDHFR, despite the fact that chiral mixtures (E:Z ratios of 2:1, 3:1 and 3:2) of the inhibitors were incubated with hDHFR prior to crystallization. Superposition of the hDHFR complexes with E2 and Z3 shows that the 2′-methoxyphenyl ring of E2 is perpendicular to that of Z3. The most potent inhibitor in this series is the isopropyl analog Z3 and the least potent is the isobutyl analog E6, consistent with data that show that the Z isomer makes the most favorable interactions with the active-site residues. The isobutyl moiety of E6 is observed in two orientations and the resultant steric crowding of the E6 analog is consistent with its weaker activity. The alternative binding modes observed for the furopyrimidine ring in these E/Z isomers suggest that new templates can be designed to probe these binding

  7. Neutron Damage and MAX Phase Ternary Compounds

    Energy Technology Data Exchange (ETDEWEB)

    Barsoum, Michael [Drexel Univ., Philadelphia, PA (United States); Hoffman, Elizabeth [Savannah River Site (SRS), Aiken, SC (United States). Savannah River National Lab. (SRNL); Sindelar, Robert [Savannah River Site (SRS), Aiken, SC (United States). Savannah River National Lab. (SRNL); Garcua-Duaz, Brenda [Savannah River Site (SRS), Aiken, SC (United States). Savannah River National Lab. (SRNL); Kohse, Gordon [Massachusetts Inst. of Technology (MIT), Cambridge, MA (United States)

    2014-06-17

    The Demands of Gen IV nuclear power plants for long service life under neutron radiation at high temperature are severe. Advanced materials that would withstand high temperatures (up to 1000+ C) to high doses in a neutron field would be ideal for reactor internal structures and would add to the long service life and reliability of the reactors. The objective of this work is to investigate the response of a new class of machinable, conductive, layered, ternary transition metal carbides and nitrides - the so-called MAX phases - to low and moderate neutron dose levels.

  8. 三元TBZ/HPB-铜(Ⅱ)-L-蛋氨酸配合物的合成、表征、抑菌活性及与DNA的作用%Syntheses, Characterization, Antibacterial Activities of Ternary Copper(Ⅱ)Complexes with 2-(4′-Thiazolyl)benzimidazole/2-(2-pyridyl)benzimidazole and L-Methionine and Their Interaction with DNA

    Institute of Scientific and Technical Information of China (English)

    卢艳梅; 区志镔; 刘海峰; 乐学义

    2011-01-01

    本文合成了2个新的三元铜(Ⅱ)配合物:[Cu(TBZ)(L-Met)(H2O)]ClO4·H2O(1)和[Cu(HPB)(L-Met)]ClO4(2)[TBZ=2-(4′-噻唑基)苯并咪唑,HPB=2-(2-吡啶)苯并咪唑,L-Met=L-蛋氨酸].通过元素分析、摩尔电导率、IR、UV-Vis及电喷雾质谱对这些配合物进行了表征.用二倍稀释法研究了配合物的抗菌活性,发现配合物对金黄色葡萄球菌(Staphylococcus aureus,G+),枯草杆菌(Bacillus subtilis,G+),沙门氏杆菌(Salmonella,G-)和大肠杆菌(Escherichia coil,G-)具有良好的抑制作用.采用电子吸收光谱、荧光光谱、粘度测定及琼脂凝胶电泳方法研究了配合物与DNA的相互作用,结果表明,配合物以插入方式与DNA作用,在维生素C存在下通过羟自由基·OH,单线态氧1O2或者1O2类似物如Cu-O2,切割pBR322 DNA双螺旋结构.%Two new ternary copper(Ⅱ) complexes: [Cu(TBZ)(L-Met)(H2O)]ClO4.H2O (1) and [Cu(HPB)(L-Met)]ClO4 (2) [TBZ=2-(4'-thiazolyl)benzimidazole, HPB=2-(2-pyridyl)benzimidazole, L-Met=L-methionine], were synthesized and characterized by elemental analysis, molar conductivity, IR, UV-Vis spectroscopy and ES-MS. The complexes were assayed against gram-positive (Staphylococcus aureus, Bacillus subtilis) and gram-negative (Salmonella,Escherichia coil) bacteria by doubling dilutions method, and the interaction of the complexes to DNA was investigated by electronic absorption spectroscopy, fluorescence spectroscopy, viscosity measurements and agarose gel electrophoresis. The results indicated that the complexes could bind to DNA by intercalative mode, and cleave pBR322 DNA in the presence of vitamin C in the involvement of the hydroxyl radical,and may be a singlet oxygen or a singlet oxygen-like entity such as copper-peroxide Cu-O2, with the order of the binding ability and cleavage activity of the complexes to DNA: complex 2>1.

  9. Synthesis, antibacterial activities and interaction with DNA of ternary copper( Ⅱ )complexes with 2-aminomethylbenzimidazole and carboxylic acid%2-氨甲基苯并咪唑-铜(Ⅱ)-羧酸配合物的合成、抗菌活性及与DNA的作用

    Institute of Scientific and Technical Information of China (English)

    赵盼; 吴海雷; 王璐; 陈实; 周晓华

    2011-01-01

    Two new ternary copper(Ⅱ)complexes:[Cu( AMB) (L-Tyr)Cl] · 1. 2H2O(l)and[ Cu2( AMB)2( NAA)2C12] · H20 (2) [ AMB = 2-aminomethylbenzimidazole,L-Tyr=L-tyrosine,NAA = 1-naphthlcetic acid] ,were synthesized and characterized by elemental analysis,molar conductivity, IR and UV-Vis spectroscope. The complex 1 and 2 were assayed against gram-positive and gram-negative bacteria by doubling dilutions method, and the interaction with CT-DNA of the two complexes was investigated by e-lectronic absorption spectroscopy, fluorescence spectroscopy, viscosity measurements and agarose gel electrophoresis. The results indicated that the complexes could bind to DNA by intercalative mode,and cleave Pbr322 DNA in the presence of vitamin C in the involvement of the hydroxyl radical oxidation mechanism, with the order of the binding ability and cleavage activity of the complexes to DNA:complex 2>1.%合成了2个三元铜(Ⅱ)配合物:[ Cu(AMB)(L-Tyr)Cl]·1.2H2O(1)和[Cu2(AMB) 2(NAA)2Cl2]·H2O(2)[ AMB=2-氨甲基苯并咪唑,L-Tyr=L-酪氨酸,NAA=萘乙酸根],并通过元素分析、摩尔电导率、IR和UV-Vis对配合物1和2进行了表征.用二倍稀释法测定了配合物1和2的抗菌活性,发现配合物1和2对金黄色葡萄球菌(Staphylococcus aureus,G+)、枯草杆菌(Bacillus subtilis,G+)、沙门氏杆菌(Salmonella,G-)和大肠杆菌( Escherichia coil,G-)具有良好的抑制作用.采用电子吸收光谱、荧光光谱、粘度及琼脂糖凝胶电泳方法研究了配合物1和2与CT-DNA的相互作用.结果表明,2个配合物均以插入方式与CT-DNA作用;在V.存在下,通过·OH氧化机理切割pBR322 DNA双螺旋结构.2个配合物与CT-DNA相互作用和切割pBR322DNA的强弱均为:配合物2>配合物1.

  10. EuF3-NaYF4纳米晶/PNIPAm三元复合凝胶的荧光温敏行为与影响机制%Thermosensitive Fluorescent Behavior and Mechanism of EuF3-NaYF4 Nanoorystals/PNIPAm Ternary Complex Hydrogel

    Institute of Scientific and Technical Information of China (English)

    宋秋生; 高康; 姚伟; 杨洋; 马海红

    2012-01-01

    分别采用水热法制备EuF3与NaYF4纳米晶, 与N-异丙基丙烯酰胺(NIPAm)混合后进行自由基聚合, 一步法合成EuF3-NaYF4纳米晶/聚N-异丙基丙烯酰胺(PNIPAm)三元复合凝胶。 对纳米晶与复合凝胶的结构与荧光性能进行了表征。 重点研究了三元复合凝胶的荧光温敏行为, 并对其影响机制进行了探讨。 结果表明, EuF3与NaYF4纳米晶在PNIPAm凝胶基体中的体相掺杂, 同样产生了明显的能量传递。 两种纳米晶相对含量的变化, 对复合凝胶的荧光温敏性能有重要影响。%In this work, EuF3 and NaYF4 nanocrystals were prepared by liquid-solution-solid (LSS) method respectively, high-resolution transmission electron microscopy (HRTEM) images revealed that the as-prepared NaYF4 nanocrystals were monodisperse nanoparticles with the size about 30 nm; while the as-prepared EuF3 were polydisperse nanoparticles with the size of 5~20 nm. And they were used to prepare a series of novel ternary complex hydrogels of EuF3-NaYF4 nanocrystals/poly(N-isopropyl acrylamide) (PNIPAm) by free radical polymerization. In a typical synthesis, 2 mg the as-prepared EuF3 and NaYF4 nanocrystals, 201.6 mg reactants of N-isopropyl acrylamide (NIPAm), N,N'-methylenebisacrylamide (BIS) and azodiisobutyronitrile (AIBN) (mNIPAm∶mBIS∶mAIBN=200/0.2/1.4) and 4 mL CHCl3 were mixed and added into a 10 mL sealing tube. The tube was placed into an ultrasonic oscillator for about 10 min to obtain a uniform mixture, and then oxygen was removed by bubbling N2 and successfully exerting vacuum on the tube for about 5 min. After the operation was repeated three times, the tube was sealed and kept at 60 ℃ for 3 h. After that, the crude complex hydrogels were synthesized. Finally, the crude hydrogels were immersed into deionized water to remove the remained monomers and impurities. The total time of soaking was about 7 d, and the deionized water was replaced every 10 h. Following the above

  11. Binary and Ternary Fission Within the Statistical Model

    Science.gov (United States)

    Adamian, Gurgen G.; Andreev, Alexander V.; Antonenko, Nikolai V.; Scheid, Werner

    The binary and ternary nuclear fission are treated within the statistical model. At the scission point we calculate the potentials as functions of the deformations of the fragments in the dinuclear model. The potentials give the mass and charge distributions of the fission fragments. The ternary fission is assumed to occur during the binary fission.

  12. Density-Driven segregation in Binary and Ternary Granular Systems

    NARCIS (Netherlands)

    Windows-Yule, Kit; Parker, David

    2015-01-01

    We present a first experimental study of density-induced segregation within a three-dimensional, vibrofluidised, ternary granular system. Using Positron Emission Particle Tracking (PEPT), we study the steady-state particle distributions achieved by binary and ternary granular beds under a variety of

  13. Density-Driven segregation in Binary and Ternary Granular Systems

    NARCIS (Netherlands)

    Windows-Yule, Kit; Parker, David

    2015-01-01

    We present a first experimental study of density-induced segregation within a three-dimensional, vibrofluidised, ternary granular system. Using Positron Emission Particle Tracking (PEPT), we study the steady-state particle distributions achieved by binary and ternary granular beds under a variety of

  14. Demonstration of Complementary Ternary Graphene Field-Effect Transistors

    Science.gov (United States)

    Kim, Yun Ji; Kim, So-Young; Noh, Jinwoo; Shim, Chang Hoo; Jung, Ukjin; Lee, Sang Kyung; Chang, Kyoung Eun; Cho, Chunhum; Lee, Byoung Hun

    2016-12-01

    Strong demand for power reduction in state-of-the-art semiconductor devices calls for novel devices and architectures. Since ternary logic architecture can perform the same function as binary logic architecture with a much lower device density and higher information density, a switch device suitable for the ternary logic has been pursued for several decades. However, a single device that satisfies all the requirements for ternary logic architecture has not been demonstrated. We demonstrated a ternary graphene field-effect transistor (TGFET), showing three discrete current states in one device. The ternary function was achieved by introducing a metal strip to the middle of graphene channel, which created an N-P-N or P-N-P doping pattern depending on the work function of the metal. In addition, a standard ternary inverter working at room temperature has been achieved by modulating the work function of the metal in a graphene channel. The feasibility of a ternary inverter indicates that a general ternary logic architecture can be realized using complementary TGFETs. This breakthrough will provide a key stepping-stone for an extreme-low-power computing technology.

  15. Amorphous ternary cyclodextrin nanocomposites of telmisartan for oral drug delivery: improved solubility and reduced pharmacokinetic variability.

    Science.gov (United States)

    Sangwai, Mayur; Vavia, Pradeep

    2013-09-10

    Despite of advancements in dosage form design and use of multifunctional excipients, improvement in dissolution characteristics of molecules like Telmisartan (TEL) having exceedingly pH dependent and poor solubility profile is still challenging. The present research work explores an innovative particle engineering approach which synergistically coalesce two principally different solubility enhancement strategies namely ternary β-cyclodextrin complexation and top-down nanonization in a unit process. The research was aimed to improve solubility and reduce in vivo variability in pharmacokinetic parameters of TEL irrespective to physiological pH conditions. Ternary β-cyclodextrin nanocomposites of TEL were prepared with high pressure homogenization using meglumine as ternary component. TEL nanocomposites were thoroughly characterized for particle size, surface topology, surface charge, inclusion complexation, crystalinity, dissolution and in vivo pharmacokinetic performance in male wistar rats at fed and fasted state. TEL nanocomposites exhibited average particle size of 698 ± 23 nm. Remarkable improvement in in vitro dissolution characteristics in multimedia and biorelevant media was observed in comparison with plain drug and marketed formulation. Results of in vivo pharmacokinetic studies revealed that, nanocomposites effectively bypass variation in pharmacokinetic parameters at fed and fasted states with 346%, 315%, 301% and 321% increase in relative bioavailability compared to marketed formulation and pure TEL in fed and fasted conditions respectively.

  16. Ternary Tree and Memory-Efficient Huffman Decoding Algorithm

    Directory of Open Access Journals (Sweden)

    Pushpa R. Suri

    2011-01-01

    Full Text Available In this study, the focus was on the use of ternary tree over binary tree. Here, a new one pass Algorithm for Decoding adaptive Huffman ternary tree codes was implemented. To reduce the memory size and fasten the process of searching for a symbol in a Huffman tree, we exploited the property of the encoded symbols and proposed a memory efficient data structure to represent the codeword length of Huffman ternary tree. In this algorithm we tried to find out the staring and ending address of the code to know the length of the code. And then in second algorithm we tried to decode the ternary tree code using binary search method. In this algorithm we tried to find out the staring and ending address of the code to know the length of the code. And then in second algorithm we tried to decode the ternary tree code using binary search method.

  17. Carbonation of ternary cementitious concrete systems containing fly ash and silica fume

    Directory of Open Access Journals (Sweden)

    Eehab Ahmed Badreldin Khalil

    2015-04-01

    Full Text Available Carbonation is quite a complex physical negative effect phenomenon on concrete especially in the ones containing ternary blends of Portland Cement, fly ash, and silica fume. Nine selected concrete mixtures were prepared with various water to cementitious materials’ ratios and various cementitious contents. The concrete mixtures were adapted in such a way to have the same workability and air content. The fresh concrete properties were kept near identical in slump, air content, and unit weight. The variation was in the hardened concrete mechanical properties of compression and tension strength. The carbonation phenomenon was studied for these mixes showing at which mixes of ternary cementitious content heavy carbonation attacks maybe produced. The main components of such mixes that do affect the carbonation process with time were presented.

  18. Irregular Homogeneity Domains in Ternary Intermetallic Systems

    Directory of Open Access Journals (Sweden)

    Jean-Marc Joubert

    2015-12-01

    Full Text Available Ternary intermetallic A–B–C systems sometimes have unexpected behaviors. The present paper examines situations in which there is a tendency to simultaneously form the compounds ABx, ACx and BCx with the same crystal structure. This causes irregular shapes of the phase homogeneity domains and, from a structural point of view, a complete reversal of site occupancies for the B atom when crossing the homogeneity domain. This work reviews previous studies done in the systems Fe–Nb–Zr, Hf–Mo–Re, Hf–Re–W, Mo–Re–Zr, Re–W–Zr, Cr–Mn–Si, Cr–Mo–Re, and Mo–Ni–Re, and involving the topologically close-packed Laves, χ and σ phases. These systems have been studied using ternary isothermal section determination, DFT calculations, site occupancy measurement using joint X-ray, and neutron diffraction Rietveld refinement. Conclusions are drawn concerning this phenomenon. The paper also reports new experimental or calculated data on Co–Cr–Re and Fe–Nb–Zr systems.

  19. Global and local depletion of ternary complex limits translational elongation.

    Science.gov (United States)

    Zhang, Gong; Fedyunin, Ivan; Miekley, Oskar; Valleriani, Angelo; Moura, Alessandro; Ignatova, Zoya

    2010-08-01

    The translation of genetic information according to the sequence of the mRNA template occurs with high accuracy and fidelity. Critical events in each single step of translation are selection of transfer RNA (tRNA), codon reading and tRNA-regeneration for a new cycle. We developed a model that accurately describes the dynamics of single elongation steps, thus providing a systematic insight into the sensitivity of the mRNA translation rate to dynamic environmental conditions. Alterations in the concentration of the aminoacylated tRNA can transiently stall the ribosomes during translation which results, as suggested by the model, in two outcomes: either stress-induced change in the tRNA availability triggers the premature termination of the translation and ribosomal dissociation, or extensive demand for one tRNA species results in a competition between frameshift to an aberrant open-reading frame and ribosomal drop-off. Using the bacterial Escherichia coli system, we experimentally draw parallels between these two possible mechanisms.

  20. Complexity

    CERN Document Server

    Gershenson, Carlos

    2011-01-01

    The term complexity derives etymologically from the Latin plexus, which means interwoven. Intuitively, this implies that something complex is composed by elements that are difficult to separate. This difficulty arises from the relevant interactions that take place between components. This lack of separability is at odds with the classical scientific method - which has been used since the times of Galileo, Newton, Descartes, and Laplace - and has also influenced philosophy and engineering. In recent decades, the scientific study of complexity and complex systems has proposed a paradigm shift in science and philosophy, proposing novel methods that take into account relevant interactions.

  1. Tensiometric investigation of the interaction and phase separation in a polymer mixture–ionic surfactant ternary system

    Directory of Open Access Journals (Sweden)

    JAROSLAV M. KATONA

    2010-06-01

    Full Text Available The interaction and phase separation in a ternary mixture composed of hydroxypropyl methyl cellulose (HPMC, sodium carboxymethyl cellulose (NaCMC, and sodium dodecylsulfate (SDS were investigated by tensiometry. Surface tension measurements of binary mixtures (0.7 % HPMC and 0.00–2.00 % SDS and of ternary mixtures (0.7 % HPMC, 0.3 % NaCMC, and 0.00–2.00 % SDS were performed. The measurements indicated interaction between HPMC and SDS, which resulted in HPMC–SDS complex formation. The critical association concentration, CAC, and polymer saturation point, PSP, were determined. Phase separation of ternary HPMC/SDS/NaCMC mixtures occurs at SDS concentration > CAC, i.e., when the HPMC–SDS complex is formed. The volume of the coacervate increases with increasing SDS concentration, and at SDS concentrations > 1.00 %, the coacervate vanishes. The surface tensions (s of ternary HPMC/SDS/NaCMC mixtures in the pre-coacervation region and at the onset of the coacervation region are similar to the σ of the corresponding binary HPMC–SDS mixtures, while in the coacervation and post coacervation region, they are close to the s of the corresponding SDS solutions

  2. [Construction of Three-Dimensional Isobologram for Ternary Pollutant Mixtures].

    Science.gov (United States)

    2015-12-01

    Tongji University, Shanghai 200092, China) Isobolographic analysis was widely used in the interaction assessment of binary mixtures. However, how to construct a three-dimensional (3D) isobologram for the assessment of toxicity interaction within ternary mixtures is still not reported up to date. The main purpose of this paper is to develop a 3D isobologram where the relative concentrations of three components are acted as three coordinate axes in 3D space to examine the toxicity interaction within ternary mixtures. Taking six commonly used pesticides in China, including three herbicides (2, 4-D, desmetryne and simetryn) and three insecticides ( dimethoate, imidacloprid and propoxur) as the mixture components, the uniform design ray procedure (UD-Ray) was used to rationally design the concentration composition of various components in the ternary mixtures so that effectively and comprehensively reflected the variety of actual environmental concentrations. The luminescent inhibition toxicities of single pesticides and their ternary mixtures to Vibrio fischeri at various concentration levels were determined by the microplate toxicity analysis. Selecting concentration addition (CA) as the addition reference, 3D isobolograms were constructed to study the toxicity interactions of various ternary mixtures. The results showed that the 3D isobologram could clearly and directly exhibit the toxicity interactions of ternary mixtures, and extend the use of isobolographic analysis into the ternary mixtures.

  3. Ternary compounds and isothermal section in Lu-Fe-Ga ternary system at 773 K

    Science.gov (United States)

    Liu, Fusheng; Ao, Weiqin; Pan, Laicai; Wang, Qibao; Yan, Jialing; Li, Junqin

    2013-06-01

    The isothermal section of the Lu-Fe-Ga ternary system at 773 K was investigated and constructed based on X-ray powder diffraction analysis. Thirteen binary compounds, Lu2Fe17, Lu6Fe23, LuFe2, LuGa3, LuGa2, Lu3Ga5, LuGa, Lu3Ga2, Lu5Ga3, Fe3Ga, Fe6Ga5, Fe3Ga4, FeGa3, nine ternary solid solutions, T1-LuFe2-1.43Ga0-0.57, T2-LuFe1.34-0.92Ga0.68-1.08, T3-LuFe0.52-0.26Ga1.48-1.74, T5-LuFe2.04-1.72Ga0.96-1.28, T6-Lu6Fe23-21.4Ga0-1.6, T7-Lu2Fe17-14.5Ga0-3.5, T8-Lu2Fe12.9-8.1Ga4.1-8.9, T9-LuFe6.8-5.5Ga5.2-6.5, T10-LuFe5.2-4.5Ga6.8-7.5, and two ternary compounds, T4-LuFe2.35Ga0.65 and T11-Lu2FeGa8 have been confirmed. The structures of the five new ternary compounds or solid solution T2, T3, T4, T5 and T8 are determined by Rietveld refinement method.

  4. Complex

    African Journals Online (AJOL)

    CLEMENT O BEWAJI

    Schiff bases and their complex compounds have been studied for their .... establishing coordination of the N–(2 – hydroxybenzyl) - L - α - valine Schiff base ..... (1967); “Spectrophotometric Identification of Organic Compounds”, Willey, New.

  5. Ternary compound thin film solar cells

    Science.gov (United States)

    Kazmerski, L. L.

    1975-01-01

    A group of ternary compound semiconductor (I-III-VI2) thin films for future applications in photovoltaic devices is proposed. The consideration of these materials (CuInSe2, CuInTe2 and especially CuInS2) for long range device development is emphasized. Much of the activity to date has been concerned with the growth and properties of CuInX2 films. X-ray and electron diffraction analyses, Hall mobility and coefficient, resistivity and carrier concentration variations with substrate and film temperature as well as grain size data have been determined. Both p- and n-type films of CuInS2 and CuInSe2 have been produced. Single and double source deposition techniques have been utilized. Some data have been recorded for annealed films.

  6. Ternary alloy nanocatalysts for hydrogen evolution reaction

    Indian Academy of Sciences (India)

    SOUMEN SAHA; SONALIKA VAIDYA; KANDALAM V RAMANUJACHARY; SAMUEL E LOFLAND; ASHOK K GANGULI

    2016-04-01

    Cu–Fe–Ni ternary alloys (size ∼55–80 nm) with varying compositions viz. CuFeNi (A1), CuFe2Ni (A2) and CuFeNi2 (A3) were successfully synthesized using microemulsion. It is to be noted that synthesis of nanocrystallineternary alloys with precise composition is a big challenge which can be overcome by choosing an appropriate microemulsion system. High electrocatalytic activity towards HER in alkaline medium was achieved by the formation of alloys of metals with low and high binding energies. A high value of current density (228 mA cm$^2$) at an overpotential of 545 mV was obtained for CuFeNi (A1), which is significantly high as compared to the previously reported Ni$_{59}$Cu$_{41}$ alloy catalyst.

  7. Facile Synthesis of Ternary Boron Carbonitride Nanotubes

    Directory of Open Access Journals (Sweden)

    Luo Lijie

    2009-01-01

    Full Text Available Abstract In this study, a novel and facile approach for the synthesis of ternary boron carbonitride (B–C–N nanotubes was reported. Growth occurred by heating simple starting materials of boron powder, zinc oxide powder, and ethanol absolute at 1150 °C under a mixture gas flow of nitrogen and hydrogen. As substrate, commercial stainless steel foil with a typical thickness of 0.05 mm played an additional role of catalyst during the growth of nanotubes. The nanotubes were characterized by SEM, TEM, EDX, and EELS. The results indicate that the synthesized B–C–N nanotubes exhibit a bamboo-like morphology and B, C, and N elements are homogeneously distributed in the nanotubes. A catalyzed vapor–liquid–solid (VLS mechanism was proposed for the growth of the nanotubes.

  8. On Ternary Inclusion-Exclusion Polynomials

    CERN Document Server

    Bachman, Gennady

    2010-01-01

    Taking a combinatorial point of view on cyclotomic polynomials leads to a larger class of polynomials we shall call the inclusion-exclusion polynomials. This gives a more appropriate setting for certain types of questions about the coefficients of these polynomials. After establishing some basic properties of inclusion-exclusion polynomials we turn to a detailed study of the structure of ternary inclusion-exclusion polynomials. The latter subclass is exemplified by cyclotomic polynomials $\\Phi_{pqr}$, where $p

  9. The competition numbers of ternary Hamming graphs

    CERN Document Server

    Park, Boram

    2010-01-01

    The competition graph of a digraph D is a graph which has the same vertex set as D and has an edge between x and y if and only if there exists a vertex v in D such that (x,v) and (y,v) are arcs of D. For any graph G, G together with sufficiently many isolated vertices is the competition graph of some acyclic digraph. The competition number k(G) of a graph G is defined to be the smallest number of such isolated vertices. In general, it is hard to compute the competition number k(G) for a graph G and it has been one of important research problems in the study of competition graphs to characterize a graph by its competition number. In this paper, we give the exact values of the competition numbers of ternary Hamming graphs.

  10. ZnO based ternary transparent conductors

    Energy Technology Data Exchange (ETDEWEB)

    Polity, Angelika; Meyer, Bruno K.; Kraemer, Thorsten; Wang, Changzhong [I. Physikalisches Institut, Justus-Liebig-Universitaet Giessen, Heinrich-Buff-Ring 16, 35392 Giessen (Germany); Haboeck, Ute; Hoffmann, Axel [Institut fuer Festkoerperphysik, Technische Universitaet Berlin, Hardenbergstr. 36, 10623 Berlin (Germany)

    2006-09-15

    ZnO{sub 1-x}S {sub x} films in the whole composition range were deposited by radio-frequency reactive sputtering on different substrates. Raman measurements verified that the LO phonon of ZnO shifts towards lower frequencies as a function of the S content in the alloyed films. The composition dependence of the band gap energy in the ternary system was determined by optical transmission and the optical bowing parameter was found to be about 3 eV. We compare this behavior to ZnOSe films which can, however, only be synthesized in a narrow composition range close to the binary constituents ZnO and ZnSe. (copyright 2006 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim) (Abstract Copyright [2006], Wiley Periodicals, Inc.)

  11. Computer recognition of slag property diagrams in ternary systems

    Institute of Scientific and Technical Information of China (English)

    Jinxiong Lu; Li Wang; Jiongming Zhang; Xinhua Wang

    2004-01-01

    In order to take data information from the slag property diagram in a ternary system automatically and actually, a picture recognition and drawing software has been developed by Visual Basic 6.0 based on the image coding principle of computer system and the graphics programming method of VB. This software can transform the ternary system isopleth diagram from bitmap format to data file and establish a corresponding database which can be applied to rapidly retrieve a mass of data and make correlative thermodynamics or kinetics calculation. Besides, it still has the function of drawing the ternary system diagram which can draw different kinds of property parameters in the same diagram.

  12. Ternary particle yields in 249Cf(nth,f)

    Science.gov (United States)

    Tsekhanovich, I.; Büyükmumcu, Z.; Davi, M.; Denschlag, H. O.; Gönnenwein, F.; Boulyga, S. F.

    2003-03-01

    An experiment measuring ternary particle yields in 249Cf(nth,f) was carried out at the high flux reactor of the Institut Laue-Langevin using the Lohengrin recoil mass separator. Parameters of energy distributions were determined for 27 ternary particles up to 30Mg and their yields were calculated. The yields of 17 further ternary particles were estimated on the basis of the systematics developed. The heaviest particles observed in the experiment are 37Si and 37S; their possible origin is discussed.

  13. Proofs of two conjectures on ternary weakly regular bent functions

    OpenAIRE

    Helleseth, Tor; Hollmann, Henk D. L.; Kholosha, Alexander; Wang, Zeying; Xiang, Qing

    2008-01-01

    We study ternary monomial functions of the form $f(x)=\\Tr_n(ax^d)$, where $x\\in \\Ff_{3^n}$ and $\\Tr_n: \\Ff_{3^n}\\to \\Ff_3$ is the absolute trace function. Using a lemma of Hou \\cite{hou}, Stickelberger's theorem on Gauss sums, and certain ternary weight inequalities, we show that certain ternary monomial functions arising from \\cite{hk1} are weakly regular bent, settling a conjecture of Helleseth and Kholosha \\cite{hk1}. We also prove that the Coulter-Matthews bent functions are weakly regular.

  14. Pb-free Sn-Ag-Cu ternary eutectic solder

    Energy Technology Data Exchange (ETDEWEB)

    Anderson, I.E.; Yost, F.G.; Smith, J.F.; Miller, C.M.; Terpstra, R.L.

    1996-06-18

    A Pb-free solder includes a ternary eutectic composition consisting essentially of about 93.6 weight % Sn-about 4.7 weight % Ag-about 1.7 weight % Cu having a eutectic melting temperature of about 217 C and variants of the ternary composition wherein the relative concentrations of Sn, Ag, and Cu deviate from the ternary eutectic composition to provide a controlled melting temperature range (liquid-solid ``mushy`` zone) relative to the eutectic melting temperature (e.g. up to 15 C above the eutectic melting temperature). 5 figs.

  15. Surface exciton-polaritons in ternary mixed crystals

    Institute of Scientific and Technical Information of China (English)

    2007-01-01

    The surface exciton-polaritons in ternary mixed crystals are investigated. The numerical calculations for several Ⅲ-Ⅴ and Ⅱ-Ⅵ compound systems are performed and the polariton frequencies as functions of the wave-vector and the compositions for ternary mixed crystals AlxGa1-xAs, CdxZn1-xSe and AlxGa1-xN as examples are given and discussed. The results show that the dependence of the energies of surface polaritons on the composition of ternary mixed crystals are slightly nonlinear different from the bulk modes.

  16. The Mapping Synthesis of Ternary Functions under Fixed Polarities

    Institute of Scientific and Technical Information of China (English)

    陈偕雄; 吴浩敏

    1993-01-01

    This paper proposes a mapping method simplifying the Reed-Muller expansion(“RM expansion”)of a ternary function under fixed polarities and the transformation of the RM expansion coefficients with different fixed polarities.

  17. Multistate Memristive Tantalum Oxide Devices for Ternary Arithmetic

    Science.gov (United States)

    Kim, Wonjoo; Chattopadhyay, Anupam; Siemon, Anne; Linn, Eike; Waser, Rainer; Rana, Vikas

    2016-01-01

    Redox-based resistive switching random access memory (ReRAM) offers excellent properties to implement future non-volatile memory arrays. Recently, the capability of two-state ReRAMs to implement Boolean logic functionality gained wide interest. Here, we report on seven-states Tantalum Oxide Devices, which enable the realization of an intrinsic modular arithmetic using a ternary number system. Modular arithmetic, a fundamental system for operating on numbers within the limit of a modulus, is known to mathematicians since the days of Euclid and finds applications in diverse areas ranging from e-commerce to musical notations. We demonstrate that multistate devices not only reduce the storage area consumption drastically, but also enable novel in-memory operations, such as computing using high-radix number systems, which could not be implemented using two-state devices. The use of high radix number system reduces the computational complexity by reducing the number of needed digits. Thus the number of calculation operations in an addition and the number of logic devices can be reduced. PMID:27834352

  18. Multistate Memristive Tantalum Oxide Devices for Ternary Arithmetic

    Science.gov (United States)

    Kim, Wonjoo; Chattopadhyay, Anupam; Siemon, Anne; Linn, Eike; Waser, Rainer; Rana, Vikas

    2016-11-01

    Redox-based resistive switching random access memory (ReRAM) offers excellent properties to implement future non-volatile memory arrays. Recently, the capability of two-state ReRAMs to implement Boolean logic functionality gained wide interest. Here, we report on seven-states Tantalum Oxide Devices, which enable the realization of an intrinsic modular arithmetic using a ternary number system. Modular arithmetic, a fundamental system for operating on numbers within the limit of a modulus, is known to mathematicians since the days of Euclid and finds applications in diverse areas ranging from e-commerce to musical notations. We demonstrate that multistate devices not only reduce the storage area consumption drastically, but also enable novel in-memory operations, such as computing using high-radix number systems, which could not be implemented using two-state devices. The use of high radix number system reduces the computational complexity by reducing the number of needed digits. Thus the number of calculation operations in an addition and the number of logic devices can be reduced.

  19. The role of In in III-nitride ternary semiconductors

    CERN Multimedia

    Redondo cubero, A

    This proposal aims to study the role of In in the outstanding efficiency of luminescent devices based on group III-nitride ternary semiconductors. To study the microscopic environments of In in GaInN and AlInN, Perturbed Angular Correlation (PAC) experiments will be performed using the PAC-probes $^{111m}$Cd($^{111}$Cd), $^{115}$Cd($^{115}$In) and $^{117}$Cd($^{117}$In). Temperature dependent PAC measurements using the $^{111}$In($^{111}$Cd) probe indicated that In in GaN and AlN forms a complex with a defect, possibly a nitrogen vacancy (V$_{N}$), which is stable up to high temperatures and might be involved in the luminescence mechanisms. Analysing these results two questions arose: \\\\ \\\\1. Does the fact that the actual measurement is performed with the daughter nucleus $^{111}$Cd (being an acceptor) influence the probe-defect interaction? This question can be answered by performing measurements with the complementary probe $^{117}$Cd($^{117}$In). \\\\ \\\\ 2. What is the significance of $\\textit{a...

  20. Ternary cluster decay within the liquid drop model

    CERN Document Server

    Royer, G; Dubillot, M; Leonard, E

    2008-01-01

    Longitudinal ternary and binary fission barriers of $^{36}$Ar, $^{56}$Ni and $^{252}$Cf nuclei have been determined within a rotational liquid drop model taking into account the nuclear proximity energy. For the light nuclei the heights of the ternary fission barriers become competitive with the binary ones at high angular momenta since the maximum lies at an outer position and has a much higher moment of inertia.

  1. Ternary cluster decay within the liquid drop model

    Science.gov (United States)

    Royer, G.; Degiorgio, K.; Dubillot, M.; Leonard, E.

    2008-05-01

    Longitudinal ternary and binary fission barriers of 36Ar, 56Ni and 252Cf nuclei have been determined within a rotational liquid drop model taking into account the nuclear proximity energy. For the light nuclei the heights of the ternary fission barriers become competitive with the binary ones at high angular momenta since the maximum lies at an outer position and has a much higher moment of inertia.

  2. Regularities of Formation of Ternary Intermetallic Compound between Transition Elements

    Institute of Scientific and Technical Information of China (English)

    Lixiu YAO; Jie YANG; Chenzhou YE; Nianyi CHEN

    2001-01-01

    Four parameters, φ (electronegativity), nws1/3 (valence electron density in Wagner-Seitz cell),R (Pauling's metallic radius) and Z (number of valence electrons in atom), and the pattern recognition methods were used to investigate the regularities of formation of ternary intermetallic compounds between three transition elements. The obtained mathematical model expressed by some inequalities can be used as a criterion of ternary compound formation in "unknown" phase diagrams of alloy systems.

  3. Impact of ternary blends of biodiesel on diesel engine performance

    Directory of Open Access Journals (Sweden)

    Prem Kumar

    2016-06-01

    Full Text Available The Pongamia and waste cooking oils are the main non edible oils for biodiesel production in India. The aim of the present work is to evaluate the fuel properties and investigate the impact on engine performance using Pongamia and waste cooking biodiesel and their ternary blend with diesel. The investigation of the fuel properties shows that Pongamia biodiesel and waste cooking biodiesel have poor cold flow property. This will lead to starting problem in the engine operation. To overcome this problem the ternary blends of diesel, waste cooking biodiesel and Pongamia biodiesel are prepared. The cloud and pour point for ternary blend, (WCB20:PB20:D60 were found to be 7 °C and 6.5 °C which are comparable to cloud and pour point of diesel 6 °C and 5 °C, respectively. The result of the test showed that brake specific fuel consumption for Pongamia biodiesel and waste cooking biodiesel is higher than ternary blend, (WCB20:PB20:D60 due to their lower energy content. The brake thermal efficiency of ternary blend and diesel is comparable while the Pongamia and waste cooking biodiesel have low efficiency. The result of investigation showed that ternary blend can be developed as alternate fuel.

  4. Maxwell-Stefan diffusion coefficient estimation for ternary systems: an ideal ternary alcohol system.

    Science.gov (United States)

    Allie-Ebrahim, Tariq; Zhu, Qingyu; Bräuer, Pierre; Moggridge, Geoff D; D'Agostino, Carmine

    2017-06-21

    The Maxwell-Stefan model is a popular diffusion model originally developed to model diffusion of gases, which can be considered thermodynamically ideal mixtures, although its application has been extended to model diffusion in non-ideal liquid mixtures as well. A drawback of the model is that it requires the Maxwell-Stefan diffusion coefficients, which are not based on measurable quantities but they have to be estimated. As a result, numerous estimation methods, such as the Darken model, have been proposed to estimate these diffusion coefficients. However, the Darken model was derived, and is only well defined, for binary systems. This model has been extended to ternary systems according to two proposed forms, one by R. Krishna and J. M. van Baten, Ind. Eng. Chem. Res., 2005, 44, 6939-6947 and the other by X. Liu, T. J. H. Vlugt and A. Bardow, Ind. Eng. Chem. Res., 2011, 50, 10350-10358. In this paper, the two forms have been analysed against the ideal ternary system of methanol/butan-1-ol/propan-1-ol and using experimental values of self-diffusion coefficients. In particular, using pulsed gradient stimulated echo nuclear magnetic resonance (PGSTE-NMR) we have measured the self-diffusion coefficients in various methanol/butan-1-ol/propan-1-ol mixtures. The experimental values of self-diffusion coefficients were then used as the input data required for the Darken model. The predictions of the two proposed multicomponent forms of this model were then compared to experimental values of mutual diffusion coefficients for the ideal alcohol ternary system. This experimental-based approach showed that the Liu's model gives better predictions compared to that of Krishna and van Baten, although it was only accurate to within 26%. Nonetheless, the multicomponent Darken model in conjunction with self-diffusion measurements from PGSTE-NMR represents an attractive method for a rapid estimation of mutual diffusion in multicomponent systems, especially when compared to exhaustive

  5. Neutron spin echo studies of the effects of temperature and pressure in a ternary microemulsion

    CERN Document Server

    Kawabata, Y; Seto, H; Takeda, T; Komura, S; Schwahn, D

    2002-01-01

    In order to clarify the self-assembling mechanisms in complex fluids involving amphiphiles, we have investigated dynamic features of amphiphilic membranes and droplets at high temperature and at high pressure in a ternary microemulsion, consisting of AOT, water, and n-decane. A high-pressure cell for neutron spin echo (NSE) experiments has been improved, and the static and dynamic features of droplets are observed in detail by means of small angle neutron scattering and NSE. It is found that the size fluctuation and the diffusion of droplets are enhanced by increasing temperature, while they are suppressed by increasing pressure. (orig.)

  6. Synthesis and characterization of the ternary telluroargentate K4[Ag18Te11

    KAUST Repository

    Davaasuren, Bambar

    2014-10-19

    The ternary potassium telluroargentate(I), K4[Ag18Te11], was prepared by solvothermal synthesis in ethylenediamine at 160 °C. It crystallizes in the cubic space group Fm3¯ m (no. 225) with the cell parameter a = 18.6589(6) Å. The crystal structure can be described as a [Ag18Te11]4- three-dimensional anionic framework with the voids accommodating potassium cations. Chemical bonding analysis reveals polar covalent Ag-Te bonds and considerable Ag-Ag interactions, which support the complex anionic character of the structure. The compound is thermally stable up to 450 °C in an inert atmosphere.

  7. In-beam investigation of ternary fission

    Science.gov (United States)

    Kotte, R.; Fromm, W. D.; Hentschel, E.; Ortlepp, H. G.; Schilling, K. D.; Seidel, W.; Stary, F.; Zwicker, G.

    1988-06-01

    Nuclear fission accompanied by long-range alpha particles has been investigated. Fission was induced by irradiating a natural uranium target with 13.5 MeV deuterons. The alpha energy and angular distributions are similar to those observed in spontaneous or thermal neutron induced fission. The correlation angle between alpha particles and light fission fragments has a most probable value ofbar \\vartheta _{l f - α } = 82.1^circ ± 0.9^circ and a dispersion (FWHM) of Δϑ=18.4°±1.2°. The mean value and dispersion of the energy distribution arebar E_α = 14.8 ± 1.0 MeV and ΔE=9.1±1.2 MeV (FWHM), respectively. The peak-to-valley ratio of the ternary fission fragment mass distribution is found to increase with increasing alpha energy. For near-symmetric mass division, a strong broadening of the angular distribution is observed. The results are discussed in the frame of a multichannel-fission model.

  8. Phase Stability and Ionic Conductivity of NASICON-Like Phases in ScPO4-Na3PO4-Li3PO4 Ternary System

    Institute of Scientific and Technical Information of China (English)

    2006-01-01

    Phase formation in ternary system of complex Sc, Na and Li phosphates was studied at 950 ℃ and synthesis of new phases of definite composition was carried out. Obtained specimens were investigated with X-ray powder diffraction, infrared and impedance spectroscopy. Compositions of fields of homogeneity with NASICON-like structure were discovered. Temperature dependency of ionic conductivity was measured.

  9. Liquid-liquid equilibria for ternary polymer mixtures

    Energy Technology Data Exchange (ETDEWEB)

    Oh, Suk Yung [Division of Chemical Engineering and Molecular Thermodynamics Laboratory, Hanyang University, Seoul 133-791 (Korea, Republic of); Bae, Young Chan, E-mail: ycbae@hanyang.ac.kr [Division of Chemical Engineering and Molecular Thermodynamics Laboratory, Hanyang University, Seoul 133-791 (Korea, Republic of)

    2011-01-24

    Graphical abstract: We developed a molecular thermodynamic model for multicomponent systems and discribed the phase equilibrium for ternary polymer mixtures by using the model parameters obtained from the binary systems. Research highlights: {yields} Model parameters were obtained from the binary systems. {yields} The obtained parameters were directly used to predict the ternary data. {yields} The undetermined parameters were used to correlate the ternary data. {yields} The proposed model agreed well with the experimental data. - Abstract: A molecular thermodynamic model for multicomponent systems based on a closed-packed lattice model is presented based on two contributions; entropy and energy contribution. The calculated liquid-liquid equilibria of ternary chainlike mixtures agreed with Monte Carlo simulation results. The proposed model can satisfactorily predict Types 0, 1, 2 and 3 phase separations of the Treybal classification. The model parameters obtained from the binary systems were used to directly predict real ternary systems and the calculated results correlated well with experimental data using few adjustable parameters. Specific interactions in associated binary systems were considered using a secondary lattice.

  10. Diffuse interface simulation of ternary fluids in contact with solid

    Science.gov (United States)

    Zhang, Chun-Yu; Ding, Hang; Gao, Peng; Wu, Yan-Ling

    2016-03-01

    In this article we developed a geometrical wetting condition for diffuse-interface simulation of ternary fluid flows with moving contact lines. The wettability of the substrate in the presence of ternary fluid flows is represented by multiple contact angles, corresponding to the different material properties between the respective fluid and the substrate. Displacement of ternary fluid flows on the substrate leads to the occurrence of moving contact point, at which three moving contact lines meet. We proposed a weighted contact angle model, to replace the jump in contact angle at the contact point by a relatively smooth transition of contact angle over a region of 'diffuse contact point' of finite size. Based on this model, we extended the geometrical formulation of wetting condition for two-phase flows with moving contact lines to ternary flows with moving contact lines. Combining this wetting condition, a Navier-Stokes solver and a ternary-fluid model, we simulated two-dimensional spreading of a compound droplet on a substrate, and validated the numerical results of the drop shape at equilibrium by comparing against the analytical solution. We also checked the convergence rate of the simulation by investigating the axisymmetric drop spreading in a capillary tube. Finally, we applied the model to a variety of applications of practical importance, including impact of a circular cylinder into a pool of two layers of different fluids and sliding of a three-dimensional compound droplet in shear flows.

  11. Neutronless $^{10}Be$-Accompanied Ternary Fission of $^{252}Cf$

    CERN Document Server

    Sandulescu, A; Misicu, S; Florescu, A; Ramayya, A V; Hamilton, J H; Greiner, W

    1998-01-01

    A new type of decay corresponding to the neutronless $^{10}$Be-accompanied fragmentation of $^{252}$Cf is studied. We employ a cluster model similar to the model used for the description of cluster radioactivity. No preformation factors were considered. The ternary relative isotopic yields were calculated as the ratio of the penetrability of a given ternary fragmentation over the sum of penetrabilities of all possible ternary neutronless fragmentations. The corresponding barriers between the light and heavy fragment and between the $^{10}$Be cluster and the two heavier fragments were computed with the help of a double folding potential generated by M3Y-$NN$ effective interaction and realistic fragment ground state deformations. Also, we studied the influence of the fragment excitation energies on the yields, by including the level densities and the $\\beta$-stretching of the fragments. The new phenomenon could be experimentally observed by the triple gamma coincidence technique between the fragments and $^{10}...

  12. Sigma Delta Modulation Based Ternary FIR Filter Mapping on FPGA

    Directory of Open Access Journals (Sweden)

    Tayabuddin Memon

    2011-07-01

    Full Text Available In this paper single-bit SDM (Sigma Delta Modulation based TFF (Ternary FIR Filter with balanced ternary coefficients (i.e. -1/0/+1 has been mapped on small commercially available FPGAs (Field Programmable Gate Arrays. Filter coefficients were obtained using second order sigma delta modulator. The filter structure is based on a hierarchical adder tree that can easily be pipelined for high performance purpose. Filter structure was coded in VHDL (Very High Speed Integrated Circuit Hardware Description Language and simulated in Quartus-II software. The filter exhibits low I/O (Input Output and core area usage and high performance-achieving clock speeds close to 200MHz on a low-cost FPGA and over 500MHz on a latest FPGA commercially available device. This single-bit ternary filter is intended to support video and audio processing applications in mobile communication systems.

  13. Completed Local Ternary Pattern for Rotation Invariant Texture Classification

    Directory of Open Access Journals (Sweden)

    Taha H. Rassem

    2014-01-01

    Full Text Available Despite the fact that the two texture descriptors, the completed modeling of Local Binary Pattern (CLBP and the Completed Local Binary Count (CLBC, have achieved a remarkable accuracy for invariant rotation texture classification, they inherit some Local Binary Pattern (LBP drawbacks. The LBP is sensitive to noise, and different patterns of LBP may be classified into the same class that reduces its discriminating property. Although, the Local Ternary Pattern (LTP is proposed to be more robust to noise than LBP, however, the latter’s weakness may appear with the LTP as well as with LBP. In this paper, a novel completed modeling of the Local Ternary Pattern (LTP operator is proposed to overcome both LBP drawbacks, and an associated completed Local Ternary Pattern (CLTP scheme is developed for rotation invariant texture classification. The experimental results using four different texture databases show that the proposed CLTP achieved an impressive classification accuracy as compared to the CLBP and CLBC descriptors.

  14. On the interpretation, verification and calibration of ternary probabilistic forecasts

    CERN Document Server

    Jupp, Tim E; Coelho, Caio A S; Stephenson, David B

    2011-01-01

    We develop a geometrical interpretation of ternary probabilistic forecasts in which forecasts and observations are regarded as points inside a triangle. Within the triangle, we define a continuous colour palette in which hue and colour saturation are defined with reference to the observed climatology. In contrast to current methods, forecast maps created with this colour scheme convey all of the information present in each ternary forecast. The geometrical interpretation is then extended to verification under quadratic scoring rules (of which the Brier Score and the Ranked Probability Score are well--known examples). Each scoring rule defines an associated triangle in which the square roots of the \\emph{score}, the \\emph{reliability}, the \\emph{uncertainty} and the \\emph{resolution} all have natural interpretations as root--mean--square distances. This leads to our proposal for a \\emph{Ternary Reliability Diagram} in which data relating to verification and calibration can be summarised. We illustrate these id...

  15. Density functional theory predictions of the composition of atomic layer deposition-grown ternary oxides.

    Science.gov (United States)

    Murray, Ciaran; Elliott, Simon D

    2013-05-01

    The surface reactivity of various metal precursors with different alkoxide, amide, and alkyl ligands during the atomic layer deposition (ALD) of ternary oxides was determined using simplified theoretical models. Quantum chemical estimations of the Brønsted reactivity of a metal complex precursor at a hydroxylated surface are made using a gas-phase hydrolysis model. The geometry optimized structures and energies for a large suite of 17 metal precursors (including cations of Mg, Ca, Sr, Sc, Y, La, Ti, Zr, Cr, Mn, Fe, Co, Ni, Cu, Zn, Al, and Ga) with five different anionic ligands (conjugate bases of tert-butanol, tetramethyl heptanedione, dimethyl amine, isopropyl amidine, and methane) and the corresponding hydrolyzed complexes are calculated using density functional theory (DFT) methods. The theoretically computed energies are used to determine the energetics of the model reactions. These DFT models of hydrolysis are used to successfully explain the reactivity and resulting stoichiometry in terms of metal cation ratios seen experimentally for a variety of ALD-grown ternary oxide systems.

  16. Kinematic Correlation of the Ternary Fission for the System 197Au + 197Au

    Science.gov (United States)

    Tian, Junlong; Li, Xian; Yan, Shiwei; Wu, Xizhen; Li, Zhuxia

    Collisions of very heavy nuclei 197Au + 197Au at the energy of 15A MeV has been studied with the improved quantum molecular dynamics model. The experimental mass distributions of ternary fission fragments for the system 197Au + 197 Au are reproduced well. The direct and sequential ternary fission modes are studied by the time dependent snapshots of typical ternary events. The analysis of deviation from Viola systematics indicates the nonstatistical feature of the ternary fission in these reactions.

  17. Ternary fission yields of 241Pu(nth,f)

    Science.gov (United States)

    Köster, Ulli; Faust, Herbert; Fioni, Gabriele; Friedrichs, Thomas; Groß, Martin; Oberstedt, Stephan

    1998-10-01

    Ternary events in the thermal neutron induced fission of 241Pu were studied with the recoil separator LOHENGRIN at the Institut Laue Langevin in Grenoble. Yields and energy distributions could be determined for most isotopes of the elements hydrogen to oxygen. Also several heavier nuclei up to 30Mg could be observed. Yields were measured for 42 isotopes, for further 17 isotopes upper limits could be deduced. For the first time the halo nuclei 11Li and 14Be were found in neutron induced fission with yields of some 10-10 per fission. This is orders of magnitude lower than predicted by most of the ternary fission models.

  18. Liquid-liquid equilibria for ternary polymer mixtures

    Science.gov (United States)

    Oh, Suk Yung; Bae, Young Chan

    2011-01-01

    A molecular thermodynamic model for multicomponent systems based on a closed-packed lattice model is presented based on two contributions; entropy and energy contribution. The calculated liquid-liquid equilibria of ternary chainlike mixtures agreed with Monte Carlo simulation results. The proposed model can satisfactorily predict Types 0, 1, 2 and 3 phase separations of the Treybal classification. The model parameters obtained from the binary systems were used to directly predict real ternary systems and the calculated results correlated well with experimental data using few adjustable parameters. Specific interactions in associated binary systems were considered using a secondary lattice.

  19. PM1 steganographic algorithm using ternary Hamming Code

    Directory of Open Access Journals (Sweden)

    Kamil Kaczyński

    2015-12-01

    Full Text Available PM1 algorithm is a modification of well-known LSB steganographic algorithm. It has increased resistance to selected steganalytic attacks and increased embedding efficiency. Due to its uniqueness, PM1 algorithm allows us to use of larger alphabet of symbols, making it possible to further increase steganographic capacity. In this paper, we present the modified PM1 algorithm which utilizies so-called syndrome coding and ternary Hamming code. The modified algorithm has increased embedding efficiency, which means fewer changes introduced to carrier and increased capacity.[b]Keywords[/b]: steganography, linear codes, PM1, LSB, ternary Hamming code

  20. An approach to determine enthalpies of formation for ternary compounds

    Directory of Open Access Journals (Sweden)

    Du Y.

    2010-01-01

    Full Text Available An integrated approach of experiment and theoretical computation to acquire enthalpies of formation for ternary compounds is described. The enthalpies of formation (DHf for Al71Fe19Si10 and Al31Mn6Ni2 are measured via a calorimeter. Miedema model, CALPHAD and first-principles method are employed to calculate DHf for the above compounds and several Al-based ternary compounds. It is found that first-principles generated data yield good agreements with experimental values and thus can be used as key 'experimental data', which are needed for CALPHAD approach.

  1. Ternary Weakly Amenable C*-algebras and JB*-triples

    CERN Document Server

    Ho, Tony; Russo, Bernard

    2012-01-01

    A well known result of Haagerup from 1983 states that every C*-algebra A is weakly amenable, that is, every (associative) derivation from A into its dual is inner. A Banach algebra B is said to be ternary weakly amenable if every continuous Jordan triple derivation from B into its dual is inner. We show that commutative C*-algebras are ternary weakly amenable, but that B(H) and K(H) are not, unless H is finite dimensional. More generally, we inaugurate the study of weak amenability for Jordan Banach triples, focussing on commutative JB*-triples and some Cartan factors.

  2. Thermodynamic description of Au-Ag-Si ternary system

    Institute of Scientific and Technical Information of China (English)

    2007-01-01

    Based on the available experimental information, the Ag-Si binary system was thermodynamically assessed using the CALPHAD method. The solution phases, including liquid, fcc-Al and diamond-A4, were modeled as substitutional solutions, of which the excess Gibbs energies were expressed by Redlich-Kister polynomial functions. Combined with previous assessment of the Ag-Au and Au-Si binary systems, thermodynamic description of the Au-Ag-Si ternary system was performed to reproduce the reported phase equilibria. Thermodynamic properties of liquid alloys, liquidus projection and several vertical and isothermal sections of this ternary system were calculated, which are in reasonable agreement with the reported experimental data.

  3. Ternary jitter-based true random number generator

    Science.gov (United States)

    Latypov, Rustam; Stolov, Evgeni

    2017-01-01

    In this paper a novel family of generators producing true uniform random numbers in ternary logic is presented. The generator consists of a number of identical ternary logic combinational units connected into a ring. All the units are provided to have a random delay time, and this time is supposed to be distributed in accordance with an exponential distribution. All delays are supposed to be independent events. The theory of the generator is based on Erlang equations. The generator can be used for test production in various systems. Features of multidimensional random vectors, produced by the generator, are discussed.

  4. Modelling of volumetric properties of binary and ternary mixtures by CEOS, CEOS/GE and empirical models

    Directory of Open Access Journals (Sweden)

    BOJAN D. DJORDJEVIC

    2007-12-01

    Full Text Available Although many cubic equations of state coupled with van der Waals-one fluid mixing rules including temperature dependent interaction parameters are sufficient for representing phase equilibria and excess properties (excess molar enthalpy HE, excess molar volume VE, etc., difficulties appear in the correlation and prediction of thermodynamic properties of complex mixtures at various temperature and pressure ranges. Great progress has been made by a new approach based on CEOS/GE models. This paper reviews the last six-year of progress achieved in modelling of the volumetric properties for complex binary and ternary systems of non-electrolytes by the CEOS and CEOS/GE approaches. In addition, the vdW1 and TCBT models were used to estimate the excess molar volume VE of ternary systems methanol + chloroform + benzene and 1-propanol + chloroform + benzene, as well as the corresponding binaries methanol + chloroform, chloroform + benzene, 1-propanol + chloroform and 1-propanol + benzene at 288.15–313.15 K and atmospheric pressure. Also, prediction of VE for both ternaries by empirical models (Radojković, Kohler, Jackob–Fitzner, Colinet, Tsao–Smith, Toop, Scatchard, Rastogi was performed.

  5. Ternary self-assemblies in water

    DEFF Research Database (Denmark)

    Hill, Leila R.; Blackburn, Octavia A.; Jones, Michael W.

    2013-01-01

    The self-assembly of higher order structures in water is realised by using the association of 1,3-biscarboxylates to binuclear meta-xylyl bridged DO3A complexes. Two dinicotinate binding sites are placed at a right-angle in a rhenium complex, which is shown to form a 1 : 2 complex with α,α'-bis(E......The self-assembly of higher order structures in water is realised by using the association of 1,3-biscarboxylates to binuclear meta-xylyl bridged DO3A complexes. Two dinicotinate binding sites are placed at a right-angle in a rhenium complex, which is shown to form a 1 : 2 complex with α...

  6. Discovery of the Ternary Nanolaminated Compound Nb2GeC by a Systematic Theoretical-Experimental Approach

    Science.gov (United States)

    Eklund, Per; Dahlqvist, Martin; Tengstrand, Olof; Hultman, Lars; Lu, Jun; Nedfors, Nils; Jansson, Ulf; Rosén, Johanna

    2012-07-01

    Since the advent of theoretical materials science some 60 years ago, there has been a drive to predict and design new materials in silicio. Mathematical optimization procedures to determine phase stability can be generally applicable to complex ternary or higher-order materials systems where the phase diagrams of the binary constituents are sufficiently known. Here, we employ a simplex-optimization procedure to predict new compounds in the ternary Nb-Ge-C system. Our theoretical results show that the hypothetical Nb2GeC is stable, and excludes all reasonably conceivable competing hypothetical phases. We verify the existence of the Nb2GeC phase by thin film synthesis using magnetron sputtering. This hexagonal nanolaminated phase has a and c lattice parameters of ˜3.24Å and 12.82 Å.

  7. Label-free detection of proteins in ternary mixtures using surface-enhanced Raman scattering and protein melting profiles

    Science.gov (United States)

    Keskin, Sercan; Efeoğlu, Esen; Keçeci, Kaan; Çulha, Mustafa

    2013-03-01

    The multiplex detection of biologically important molecules such as proteins in complex mixtures has critical importance not only in disease diagnosis but also in other fields such as proteomics and biotechnology. Surface-enhanced Raman scattering (SERS) is a powerful technique for multiplex identification of molecular components in a mixture. We combined the multiplexing power of SERS and heat denaturation of proteins to identify proteins in ternary protein mixtures. The heat denaturation profiles of four model blood proteins, transferrin, human serum albumin, fibrinogen, and hemoglobin, were studied with SERS. Then, two ternary mixtures of these four proteins were used to test the feasibility of the approach. It was demonstrated that unique denaturation profiles of each protein could be used for their identification in the mixture.

  8. Copper-based diamond-like ternary semiconductors for thermoelectric applications

    Science.gov (United States)

    Skoug, Eric John

    Heightened global concern over greenhouse gas emissions has led to an increased demand for clean energy conversion technologies. Thermoelectric materials convert directly between thermal and electrical energy and can increase the efficiency of existing processes via waste heat recovery and solid-state climate control applications. The conversion efficiency of available thermoelectric materials and the devices comprised of them is unfortunately quite low, and thus new materials must be developed in order for thermoelectrics to keep pace with competing technologies. One approach to increasing the conversion efficiency of a given material is to decrease its lattice thermal conductivity, which has traditionally been accomplished by introducing phonon scattering centers into the material. These scattering centers also tend to degrade electronic transport in the material, thereby minimizing the overall effect on the thermoelectric performance. The purpose of this work is to develop materials with inherently low lattice thermal conductivity such that no extrinsic modifications are required. A novel approach in which complex ternary semiconductors are derived from well-known binary or elemental semiconductors is employed to identify candidate materials. Ternary diamond-like compounds, namely Cu2SnSe 3 and Cu3SbSe4, are synthesized, characterized, and optimized for thermoelectric applications. It is found that sample-to-sample variations in hole concentration limits the plausibility of Cu2SnSe3 as a thermoelectric material. Cu3SbSe 4 is found to be a promising material that can achieve thermoelectric performance comparable to state-of-the-art materials when optimized. This work uncovers anomalous thermal conductivity in several Cu-Sb-Se ternary compounds, which is used to develop a set of guidelines relating crystal structure to inherently low lattice thermal conductivity.

  9. A Simple Refraction Experiment for Probing Diffusion in Ternary Mixtures

    Science.gov (United States)

    Coutinho, Cecil A.; Mankidy, Bijith D.; Gupta, Vinay K.

    2010-01-01

    Diffusion is a fundamental phenomenon that is vital in many chemical processes such as mass transport in living cells, corrosion, and separations. We describe a simple undergraduate-level experiment based on Weiner's Method to probe diffusion in a ternary aqueous mixture of small molecular-weight molecules. As an illustration, the experiment…

  10. Application of Analytic Geometry to Ternary and Quaternary Diagrams.

    Science.gov (United States)

    MacCarthy, Patrick

    1986-01-01

    Advantages of representing ternary and quaternary composition diagrams by means of rectangular coordinates were pointed out in a previous paper (EJ 288 693). A further advantage of that approach is that analytic geometry, based on rectangular coordinates, is directly applicable as demonstrated by the examples presented. (JN)

  11. Demixing and gelation behavior of ternary cellulose acetate solutions

    NARCIS (Netherlands)

    Reuvers, A.J.; Altena, F.W.; Smolders, C.A.

    1986-01-01

    The demixing behavior on cooling of ternary systems of cellulose acetate/solvent/water has been examined for CA concentrations up to 40 wt% CA in several solvents. Cloud points have been measured as a function of cooling rate. The rapid process of liquid - liquid demixing can be discriminated from t

  12. Ternary diffusion path in terms of eigenvalues and eigenvectors

    Science.gov (United States)

    Ram-Mohan, L. R.; Dayananda, Mysore A.

    2016-04-01

    Based on the transfer matrix methodology, a new analysis is presented for the description of slopes of the ternary diffusion path for a solid-solid diffusion couple. Concentration profiles and diffusion paths for isothermal, ternary diffusion couples are examined in the context of eigenvalues and eigenvectors obtained from the diagonalisation of the ? ternary interdiffusion coefficients employed for their representation. New relations are derived relating the decoupled interdiffusion fluxes to combinations of concentration gradients through the major and minor eigenvalues, and the diffusion path becomes parallel to the major eigenvector at each path end. General expressions for the slope of the ternary diffusion path at any section of the couple are also derived in terms of eigenvalue and eigenvector parameters. Expressions for the path slope at the Matano plane involve only concentrations, major and minor eigenvalues and eigenvector parameters. New constraints relating the eigenvalues and the concentration gradients of the individual components are also presented at selected sections, where the diffusion path is parallel to the straight line joining the terminal composition points on an isotherm. Applications of the various relations are illustrated with the aid of a hypothetical couple and an experimental Cu-Ni-Zn diffusion couple.

  13. Using Nuclear Magnetic Resonance Spectroscopy for Measuring Ternary Phase Diagrams

    Science.gov (United States)

    Woodworth, Jennifer K.; Terrance, Jacob C.; Hoffmann, Markus M.

    2006-01-01

    A laboratory experiment is presented for the upper-level undergraduate physical chemistry curriculum in which the ternary phase diagram of water, 1-propanol and n-heptane is measured using proton nuclear magnetic resonance (NMR) spectroscopy. The experiment builds upon basic concepts of NMR spectral analysis, typically taught in the undergraduate…

  14. Intermolecular Interactions in Ternary Glycerol–Sample–H2O

    DEFF Research Database (Denmark)

    Westh, Peter; Rasmussen, Erik Lumby; Koga, Yoshikata

    2011-01-01

    We studied the intermolecular interactions in ternary glycerol (Gly)–sample (S)–H2O systems at 25 °C. By measuring the excess partial molar enthalpy of Gly, HGlyEHEGly, we evaluated the Gly–Gly enthalpic interaction, HGly-GlyEHEGly--Gly, in the presence of various samples (S). For S, tert...

  15. Studies on Molecular Interaction in Ternary Liquid Mixtures

    Directory of Open Access Journals (Sweden)

    R. Uvarani

    2010-01-01

    Full Text Available Ultrasonic velocity, density and viscosity for the ternary liquid mixtures of cyclohexanone with 1-propanol and 1-butanol in carbon tetrachloride were measured at 303 K. The acoustical parameters and their excess values were calculated. The trends in the variation of these excess parameters were used to discuss the nature and strength of the interactions present between the component molecules.

  16. A high-speed interconnect network using ternary logic

    DEFF Research Database (Denmark)

    Madsen, Jens Kargaard; Long, S. I.

    1995-01-01

    This paper describes the design and implementation of a high-speed interconnect network (ICN) for a multiprocessor system using ternary logic. By using ternary logic and a fast point-to-point communication technique called STARI (Self-Timed At Receiver's Input), the communication between the proc......This paper describes the design and implementation of a high-speed interconnect network (ICN) for a multiprocessor system using ternary logic. By using ternary logic and a fast point-to-point communication technique called STARI (Self-Timed At Receiver's Input), the communication between...... the processors is free of clock skew and insensitive to any delay differences in buffers and wires. In addition, the number of signal wires and pins are reduced by 50 percent in comparison with a similar binary implementation. The ICN architecture is based on a crossbar topology and the high-speed part consists...... of two LSI GaAs chips, Interface and Crossbar, which were implemented in a 0.8 μm MESFET process. In a 4×4 ICN, communication at 300 Mbit/s per wire was demonstrated, which is twice as fast as pure synchronous and four times faster than pure asynchronous communication in the specific test set-up...

  17. Ternary phase diagram calculations of pentaerythritol-pentaglycerine-neopentylglycol system

    Energy Technology Data Exchange (ETDEWEB)

    Mishra, A.; Talekar, A. [Chemical and Materials Engineering Department (MS388), University of Nevada, Reno, NV 89557 (United States); Chandra, D., E-mail: dchandra@unr.edu [Chemical and Materials Engineering Department (MS388), University of Nevada, Reno, NV 89557 (United States); Chien, W.-M. [Chemical and Materials Engineering Department (MS388), University of Nevada, Reno, NV 89557 (United States)

    2012-05-10

    Highlights: Black-Right-Pointing-Pointer Ternary phase diagrams of polyalcohols are developed using the CALPHAD method. Black-Right-Pointing-Pointer These ternary phase diagrams are thermodynamically calculated for the first time. Black-Right-Pointing-Pointer Orientational disorder is observed in the high temperature (energy storage) phase. Black-Right-Pointing-Pointer Polyalcohols are potential thermal energy storage materials. - Abstract: The pentaerythritol (PE)-pentaglycerine (PG)-neopentylglycol (NPG) ternary system has been thermodynamically assessed using the CALPHAD method and Thermo-Calc software. The PE-PG, PG-NPG, PE-NPG binary systems have also been calculated using CALPHAD on the basis of reported binary experimental data. The solution phases are modeled as substitutional solutions, in which the excess Gibbs energies are expressed by the Redlich-Kister-Muggianu polynomial. The PE-NPG binary phase diagram was modeled using Henrian solution model, and the liquid phase was assumed ideal. The PG-NPG system was optimized using regular and sub-regular solution models and show invariant equilibria at 298 K. The PE-NPG binary system was calculated from room temperature to the liquid phase temperatures. The modeled phase diagrams and the experimental data are in good agreement. A set of self consistent thermodynamic parameters formulating the Gibbs energies of various phases in the PE-PG-NPG ternary system are obtained in the present work. Thermodynamic properties, several vertical and isopleth sections have been calculated and are in good agreement with experimental data.

  18. Thermodynamic modeling of the Au-Sb-Si ternary system

    Energy Technology Data Exchange (ETDEWEB)

    Wang, J., E-mail: jiang.wang@empa.ch [School of Materials Science and Engineering, Guilin University of Electronic Technology, Guilin, Guangxi 541004 (China); Swiss Federal Laboratories for Materials Science and Technology, Laboratory for Joining and Interface Technology, Uberlandstrasse 129, Duebendorf, Zuerich CH-8600 (Switzerland); Liu, Y.J. [Western Transportation Institute, Montana State University, Bozeman, MT 59715 (United States); Liu, L.B. [School of Materials Science and Engineering, Central South University, Changsha, Hunan 410083 (China); Zhou, H.Y. [School of Materials Science and Engineering, Guilin University of Electronic Technology, Guilin, Guangxi 541004 (China); Jin, Z.P. [School of Materials Science and Engineering, Central South University, Changsha, Hunan 410083 (China)

    2011-02-10

    Research highlights: > Thermodynamic optimization of the Au-Sb binary system was updated. > The Si-Sb binary system was assessed from critical review of experimental information. > Thermodynamic modeling of the Au-Sb-Si ternary system was performed. > The phase relations of this ternary system are useful to design Au-based solders. - Abstract: Thermodynamic optimization of the Au-Sb binary system was updated as well as the Si-Sb binary system was assessed thermodynamically using the CALPHAD method based on the critical review of the available experimental information from the published literature. The solution phases including liquid, fcc{sub A}1(Au), diamond{sub A}4(Si) and rhombohedral{sub A}7(Sb), are modeled as substitutional solutions and their excess Gibbs energies are expressed by a Redlich-Kister polynomial. The solubility of Si in the intermetallic compound AuSb{sub 2} is not taken into account because of the lack of experimental information. Combined with previous assessment of the Au-Si binary system, thermodynamic modeling of the Au-Sb-Si ternary system was performed to reproduce well the measured phase equilibria. The liquidus projection and several vertical sections of this ternary system were calculated, which are in reasonable agreement with the reported experimental data.

  19. Ternary numbers and algebras. Reflexive numbers and Berger graphs

    CERN Document Server

    Dubrovskiy, A

    2007-01-01

    The Calabi-Yau spaces with SU(n) holonomy can be studied by the algebraic way through the integer lattice where one can construct the Newton reflexive polyhedra or the Berger graphs. Our conjecture is that the Berger graphs can be directly related with the $n$-ary algebras. To find such algebras we study the n-ary generalization of the well-known binary norm division algebras, ${\\mathbb R}$, ${\\mathbb C}$, ${\\mathbb H}$, ${\\mathbb O}$, which helped to discover the most important "minimal" binary simple Lie groups, U(1), SU(2) and G(2). As the most important example, we consider the case $n=3$, which gives the ternary generalization of quaternions and octonions, $3^n$, $n=2,3$, respectively. The ternary generalization of quaternions is directly related to the new ternary algebra and group which are related to the natural extensions of the binary $su(3)$ algebra and SU(3) group. Using this ternary algebra we found the solution for the Berger graph: a tetrahedron.

  20. Hierarchic structure formation in binary and ternary polymer blends

    NARCIS (Netherlands)

    Sprenger, M; Walheim, S; Budkowski, A; Steiner, U

    The phase morphology of multi-component polymer blends is governed by the interfacial interactions of its components. We discuss here the domain morphology in thin films of model binary and ternary polymer blends containing polystyrene, poly(methyl metacrylate), and poly(2-vinylpyridine) (PS, PMMA,

  1. Solidification of ternary systems with a nonlinear phase diagram

    Science.gov (United States)

    Alexandrov, D. V.; Dubovoi, G. Yu.; Malygin, A. P.; Nizovtseva, I. G.; Toropova, L. V.

    2017-02-01

    The directional solidification of a ternary system with an extended phase transition region is theoretically studied. A mathematical model is developed to describe quasi-stationary solidification, and its analytical solution is constructed with allowance for a nonlinear liquidus line equation. A deviation of the liquidus equation from a linear function is shown to result in a substantial change in the solidification parameters.

  2. Complex fission phenomena

    CERN Document Server

    Poenaru, D N; Greiner, W

    2005-01-01

    Complex fission phenomena can be studied in a unified way. Very general reflection asymmetrical equilibrium (saddle-point) nuclear shapes, may be obtained by solving an integro-differential equation without being necessary to specify a certain parametrization. The mass asymmetry in cold fission phenomena can be explained as the result of adding a phenomenological shell correction to the liquid drop model deformation energy. Applications to binary, ternary, and quaternary fission are outlined. Predictions of two alpha accompanied fission are experimentally confirmed.

  3. Complex fission phenomena

    Science.gov (United States)

    Poenaru, D. N.; Gherghescu, R. A.; Greiner, W.

    2005-01-01

    Complex fission phenomena are studied in a unified way. Very general reflection asymmetrical equilibrium (saddle point) nuclear shapes are obtained by solving an integro-differential equation without being necessary to specify a certain parametrization. The mass asymmetry in binary cold fission of Th and U isotopes is explained as the result of adding a phenomenological shell correction to the liquid drop model deformation energy. Applications to binary, ternary, and quaternary fission are outlined.

  4. New parameterization of sulfuric acid-ammonia-water ternary nucleation rates at tropospheric conditions

    Science.gov (United States)

    Merikanto, J.; Napari, I.; VehkamäKi, H.; Anttila, T.; Kulmala, M.

    2007-08-01

    Recently, the classical theory of sulfuric acid-ammonia-water (H2SO4-NH3-H2O) nucleation was reinvestigated by including the effect of stable ammonium bisulfate formation into calculations. The predicted nucleation rates lowered by many orders of magnitude, bringing them close to agreement with the available experiments on H2SO4-NH3-H2O nucleation. However, because of complex thermodynamics involved, the theoretical calculations of nucleation rates are computationally demanding, and sometimes the theory breaks down at specific concentrations and temperatures. Here we present parameterized equations of ternary H2SO4-NH3-H2O nucleation rates, critical cluster sizes, and critical cluster compositions. Our parameterizations reduce the computing time of these values by a factor of 105 compared with the calculations with the full thermodynamic model. Also, our parameterizations provide reliable estimates for ternary nucleation rates in cases when the full theory fails in isolated points of the parameter space. The parameterized nucleation rates are accurate to one order of magnitude in nucleation rate. Because of their computational efficiency, our parameterizations are particularly suitable for large-scale models of atmosphere. They are valid for temperatures above 235 K, sulfuric acid concentrations 5 · 104-109 cm-3, ammonia mixing ratios 0.1-1000 ppt, relative humidities 5%-95%, and nucleation rates over 10-5 cm-3 s-1. At these conditions, no significant nucleation occurs above 295 K.

  5. Prediction of the Flash Point of Binary and Ternary Straight-Chain Alkane Mixtures

    Directory of Open Access Journals (Sweden)

    X. Li

    2014-01-01

    Full Text Available The flash point is an important physical property used to estimate the fire hazard of a flammable liquid. To avoid the occurrence of fire or explosion, many models are used to predict the flash point; however, these models are complex, and the calculation process is cumbersome. For pure flammable substances, the research for predicting the flash point is systematic and comprehensive. For multicomponent mixtures, especially a hydrocarbon mixture, the current research is insufficient to predict the flash point. In this study, a model was developed to predict the flash point of straight-chain alkane mixtures using a simple calculation process. The pressure, activity coefficient, and other associated physicochemical parameters are not required for the calculation in the proposed model. A series of flash points of binary and ternary mixtures of straight-chain alkanes were determined. The results of the model present consistent experimental results with an average absolute deviation for the binary mixtures of 0.7% or lower and an average absolute deviation for the ternary mixtures of 1.03% or lower.

  6. Synthesis and crystal structure investigations of ternary oxides in the Na–Pu–O system

    Energy Technology Data Exchange (ETDEWEB)

    Bykov, D.M., E-mail: d.bykov@tudelft.nl [European Commission, Joint Research Center-Institute for Transuranium Elements, 76125 Karlsruhe (Germany); Raison, P.E., E-mail: philippe.raison@ec.europa.eu [European Commission, Joint Research Center-Institute for Transuranium Elements, 76125 Karlsruhe (Germany); Konings, R.J.M.; Apostolidis, C. [European Commission, Joint Research Center-Institute for Transuranium Elements, 76125 Karlsruhe (Germany); Orlova, M. [University of Innsbruck, Faculty of Geo- and Atmospheric Sciences, A-6020 Innsbruck (Austria)

    2015-02-15

    Highlights: • Crystalline phases in the Na–Pu–O system were obtained by solid state synthesis. • Structures of these phases were studied by the powder X-ray diffraction. • New crystalline forms of Na{sub 5}PuO{sub 5} and Na{sub 3}PuO{sub 4} were observed for the first time. • High-temperature X-ray diffraction studies were performed for Na{sub 4}PuO{sub 5} and Na{sub 5}PuO{sub 6}. • Phase diagram for the ternary Na–Pu–O system was reassessed. - Abstract: Ternary oxides of sodium and plutonium in oxidation states from +4 to +7 have been synthesized by solid state reactions at elevated temperatures in pure argon or oxygen atmospheres. Crystal structures of the obtained phases have been investigated by the Rietveld method using conventional X-ray powder diffraction technique. The structural analogs were found among the families of complex oxides of alkali elements and cerium, ruthenium, antimony, uranium/neptunium and osmium. The new results were compared to earlier literature data for the Na–Pu–O system.

  7. Ternary surface monolayers for ultrasensitive (zeptomole) amperometric detection of nucleic acid hybridization without signal amplification.

    Science.gov (United States)

    Wu, Jie; Campuzano, Susana; Halford, Colin; Haake, David A; Wang, Joseph

    2010-11-01

    A ternary surface monolayer, consisting of coassembled thiolated capture probe, mercaptohexanol and dithiothreitol, is shown to offer dramatic improvements in the signal-to-noise characteristics of electrochemical DNA hybridization biosensors based on common self-assembled monolayers. Remarkably low detection limits down to 40 zmol (in 4 μL samples) as well as only 1 CFU Escherichia coli per sensor are thus obtained without any additional amplification step in connection to the commonly used horseradish peroxidase/3,3',5,5'-tetramethylbenzidine system. Such dramatic improvements in the detection limits (compared to those of common binary alkanethiol interfaces and to those of most electrochemical DNA sensing strategies without target or signal amplification) are attributed primarily to the remarkably higher resistance to nonspecific adsorption. This reflects the highly compact layer (with lower pinhole density) produced by the coupling of the cyclic- and linear-configuration "backfillers" that leads to a remarkably low background noise even in the presence of complex sample matrixes. A wide range of surface compositions have been investigated, and the ternary mixed monolayer has been systematically optimized. Detailed impedance spectroscopy and cyclic voltammetric studies shed useful insights into the surface coverage. The impressive sensitivity and high specificity of the simple developed methodology indicate great promise for a wide range of nucleic acid testing, including clinical diagnostics, biothreat detection, food safety, and forensic analysis.

  8. Design of ternary low-power Domino JKL flip-flop and its application

    Institute of Scientific and Technical Information of China (English)

    Wang Pengjun; Yang Qiankun; Zheng Xuesong

    2012-01-01

    By researching the ternary flip-flop and the adiabatic Domino circuit,a novel design of low-power ternary Domino JKL flip-flop on the switch level is proposed.First,the switch-level structure of the ternary adiabatic Domino JKL flip-flop is derived according to the switch-signal theory and its truth table.Then the ternary loop operation circuit and ternary reverse loop operation circuit are achieved by employing the ternary JKL flip-flop.Finally,the circuit is simulated by using the Spice tool and the results show that the logic function is correct.The energy consumption of the ternary adiabatic Domino JKL flip-flop is 69% less than its conventional Domino counterpart.

  9. Optimization of Contrast-to-Tissue Ratio by Adaptation of Transmitted Ternary Signal in Ultrasound Pulse Inversion Imaging

    Directory of Open Access Journals (Sweden)

    Sébastien Ménigot

    2013-01-01

    Full Text Available Ultrasound contrast imaging has provided more accurate medical diagnoses thanks to the development of innovating modalities like the pulse inversion imaging. However, this latter modality that improves the contrast-to-tissue ratio (CTR is not optimal, since the frequency is manually chosen jointly with the probe. However, an optimal choice of this command is possible, but it requires precise information about the transducer and the medium which can be experimentally difficult to obtain, even inaccessible. It turns out that the optimization can become more complex by taking into account the kind of generators, since the generators of electrical signals in a conventional ultrasound scanner can be unipolar, bipolar, or tripolar. Our aim was to seek the ternary command which maximized the CTR. By combining a genetic algorithm and a closed loop, the system automatically proposed the optimal ternary command. In simulation, the gain compared with the usual ternary signal could reach about 3.9 dB. Another interesting finding was that, in contrast to what is generally accepted, the optimal command was not a fixed-frequency signal but had harmonic components.

  10. Quaternary complexes modified from pDNA and poly-l-lysine complexes to enhance pH-buffering effect and suppress cytotoxicity.

    Science.gov (United States)

    Kodama, Yukinobu; Yatsugi, Yuiko; Kitahara, Takashi; Kurosaki, Tomoaki; Egashira, Kanoko; Nakashima, Mikiro; Muro, Takahiro; Nakagawa, Hiroo; Higuchi, Norihide; Nakamura, Tadahiro; Sasaki, Hitoshi

    2015-04-01

    We developed a modified complex of pDNA and poly-l-lysine (PLL) by the addition of poly-l-histidine (PLH) and γ-polyglutamic acid (γ-PGA) to enhance its pH-buffering effect and suppress cytotoxicity. The binary and ternary complexes of pDNA with PLL or/and PLH showed particle sizes of approximately 52-76 nm with cationic surface charge. The ternary complexes showed much higher gene expression than the binary complexes with PLL. The mixed solution of PLL and PLH showed higher buffering capacity than PLL solution. The high gene expression of ternary complexes was reduced by bafilomycin A1 . These results indicated the addition of PLH to PLL complexes promoted endosomal escape by enhancing the pH-buffering effect. The binary and ternary complexes showed cytotoxicity and blood agglutination because of their cationic surface charge. We therefore developed quaternary complexes by the addition of anionic γ-PGA, which was reported to decrease the toxicity of cationic complexes. In fact, quaternary complexes showed no cytotoxicity and blood agglutination. Also, quaternary complexes showed higher gene expression than ternary complexes regardless of their anionic surface charge. Quaternary complexes showed selectively high gene expression in the spleen after their intravenous administration. Thus, we successfully developed the quaternary complexes with high gene expression and no toxicity.

  11. Structural studies of EF-Tu complexes

    DEFF Research Database (Denmark)

    Johansen, Jesper Sanderhoff

    2011-01-01

    proteins and 22 tRNAs and 2 rRNAs. The mammalian mitochondria have their own specialised translational system for maintaining the synthesis of the 13 proteins. The mammalian mitochondrial protein synthesis resembles the prokaryotic system more than the cytosolic system from eukaryotes. Some of the t...... and tRNASerGCU was produced by in vitro transcription. The ternary complex composed of EF-Tu:GDPNP:tRNASerGCU was reconstituted for crystallisation experiments. Unfortunately, we have not succeeding in crystallising neither the free components nor the ternary complex so far. The results of this project...

  12. Ternary Reactions in 197AU + 197AU Collisions Revisited

    Science.gov (United States)

    Skwira-Chalot, I.; Siwek-Wilczyńska, K.; Wilczyński, J.; Amorini, F.; Anzalone, A.; Auditore, L.; Baran, V.; Brzychczyk, J.; Cardella, G.; Cavallaro, S.; Chatterjee, M. B.; Colonna, M.; de Filippo, E.; di Toro, M.; Gawlikowicz, W.; Grzeszczuk, A.; Guazzoni, P.; Kowalski, S.; La Guidara, E.; Lanzanò, G.; Lanzalone, G.; Maiolino, C.; Majka, Z.; Nicolis, N. G.; Pagano, A.; Papa, M.; Piasecki, E.; Pirrone, S.; Płaneta, R.; Politi, G.; Porto, F.; Rizzo, F.; Russotto, P.; Schmidt, K.; Sochocka, A.; Świderski, Ł.; Trifirò, A.; Trimarchi, M.; Wieleczko, J. P.; Zetta, L.; Zipper, W.

    Ternary events originating from the 197Au + 197Au reaction at 15 MeV/nucleon, studied by using the multidetector array CHIMERA at LNS Catania, have been collected in almost complete 2π range of the forward hemisphere of CHIMERA thus extending the angular range of our previously reported preliminary data. Energy- and time calibrations for heavy fragments at large angles were supplemented with an analysis of coincidence events of binary strongly damped reactions. Contrary to the previous preliminary results, the new complete data clearly show presence of sequential fission processes in which one of Au-like nuclei undergoes fission after re-separation of the primary binary system. Mechanism of these two types of reactions observed in our data, sequential fission reactions and prompt ternary processes, are presently studied using comparisons with predictions of the stochastic BNV model of Baran, Colonna and Di Toro and the QMD model of Łukasik.

  13. Experimental Investigation of Ternary Alloys for Fusion Breeding Blankets

    Energy Technology Data Exchange (ETDEWEB)

    Choi, B. William [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States); Chiu, Ing L. [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States)

    2015-10-26

    Future fusion power plants based on the deuterium-tritium (DT) fuel cycle will be required to breed the T fuel via neutron reactions with lithium, which will be incorporated in a breeding blanket that surrounds the fusion source. Recent work by LLNL proposed the used of liquid Li as the breeder in an inertial fusion energy (IFE) power plant. Subsequently, an LDRD was initiated to develop alternatives ternary alloy liquid metal breeders that have reduced chemical reactivity with water and air compared to pure Li. Part of the work plan was to experimentally investigate the phase diagrams of ternary alloys. Of particular interest was measurement of the melt temperature, which must be low enough to be compatible with the temperature limits of the steel used in the construction of the chamber and heat transfer system.

  14. Lane of parallel through carry in ternary optical adder

    Institute of Scientific and Technical Information of China (English)

    JIN Yi; HE Huacan; AI Lirong

    2005-01-01

    At the present 50 to 100 microseconds are necessary for a liquid crystal to change its state from opacity to clarity; 1.14× 10-5 microseconds are however proved to be enough for light to pass through a clarity liquid crystal device. Rooted from this great difference in time, an optical adder was constructed with parallel through carry lanes (PTCL) composed of liquid crystals. Because all carries in PTCL process in parallel, the carry delay in the ternary optical computer's adder is avoided. Eliminating the carry delay in adder of ternary optical computer by physical means, the PTCL is also applicable for other types of optical adders. Moreover a light diagram of the adder and one PTCL structure are provided.

  15. Thermodynamic calculations in ternary titanium–aluminium–manganese system

    Directory of Open Access Journals (Sweden)

    ANA I. KOSTOV

    2008-04-01

    Full Text Available Thermodynamic calculations in the ternary Ti–Al–Mn system are shown in this paper. The thermodynamic calculations were performed using the FactSage thermochemical software and database, with the aim of determining thermodynamic properties, such as activities, coefficient of activities, partial and integral values of the enthalpies and Gibbs energies of mixing and excess energies at two different temperatures: 2000 and 2100 K. Bearing in mind that no experimental data for the Ti–Al–Mn ternary system have been obtained or reported. The obtained results represent a good base for further thermodynamic analysis and may be useful as a comparison with some future critical experimental results and thermodynamic optimization of this system.

  16. A comparison of pseudo-ternary diagrams of aqueous mixtures of Quil A, cholesterol and phospholipid prepared by lipid-film hydration and dialysis.

    Science.gov (United States)

    Demana, P H; Davies, N M; Berger, B; Vosgerau, U; Rades, T

    2004-05-01

    Pseudo-ternary diagrams for Quil A, phospholipid (phosphatidylcholine (PC) or phosphatidylethanolamine (PE)) and cholesterol were established in order to identify combinations that result in the formation of immune-stimulating complex (ISCOM) matrices and other colloidal structures produced by these three components in aqueous systems following lipid-film hydration or dialysis (methods that can be used to produce ISCOMs). In addition, the effect of equilibration time (1 month at 4 degrees C) on the structures formed by the various combinations of the three components was investigated. Depending on the ratio of Quil A, cholesterol and phospholipid, different colloidal particles, including ISCOM matrices, liposomes and ring-like micelles, were found irrespective of the preparation method used. In contrast, worm-like micelles were only observed in systems prepared by lipid-film hydration. For samples prepared by dialysis, ISCOM matrices were predominantly found near the Quil A apex of the pseudo-ternary diagram (> 50% Quil A). On the other hand, for samples prepared by lipid-film hydration, ISCOM matrices were predominantly found near the phospholipid apex of the pseudo-ternary diagram (> 50% phospholipid). The regions in the pseudo-ternary diagrams in which ISCOM matrices were observed increased following an extended equilibration time, particularly for samples prepared by lipid-film hydration. Differences were also observed between pseudoternary diagrams prepared using either PE or PC as phospholipids.

  17. Continuous and discontinuous precipitation in Fe-1 at.%Cr-1 at.%Mo alloy upon nitriding; crystal structure and composition of ternary nitrides

    Science.gov (United States)

    Steiner, Tobias; Ramudu Meka, Sai; Rheingans, Bastian; Bischoff, Ewald; Waldenmaier, Thomas; Yeli, Guma; Martin, Tomas L.; Bagot, Paul A. J.; Moody, Michael P.; Mittemeijer, Eric J.

    2016-05-01

    The internal nitriding response of a ternary Fe-1 at.%Cr-1 at.%Mo alloy, which serves as a model alloy for many CrMo-based steels, was investigated. The nitrides developing upon nitriding were characterised by X-ray diffraction, scanning electron microscopy, electron probe microanalysis, transmission electron microscopy and atom probe tomography. The developed nitrides were shown to be (metastable) ternary mixed nitrides, which exhibit complex morphological, compositional and structural transformations as a function of nitriding time. Analogous to nitrided binary Fe-Cr and Fe-Mo alloys, in ternary Fe-Cr-Mo alloys initially continuous precipitation of fine, coherent, cubic, NaCl-type nitride platelets, here with the composition (Cr½,Mo½)N¾, occurs, with the broad faces of the platelets parallel to the {1 0 0}α-Fe lattice planes. These nitrides undergo a discontinuous precipitation reaction upon prolonged nitriding leading to the development of lamellae of a novel, hexagonal CrMoN2 nitride along {1 1 0}α-Fe lattice planes, and of spherical cubic, NaCl-type (Cr,Mo)Nx nitride particles within the ferrite lamellae. The observed structural and compositional changes of the ternary nitrides have been attributed to the thermodynamic and kinetic constraints for the internal precipitation of (misfitting) nitrides in the ferrite matrix.

  18. Exploration of a ternary deep eutectic solvent of methyltriphenylphosphonium bromide/chalcone/formic acid for the selective recognition of rutin and quercetin in Herba Artemisiae Scopariae.

    Science.gov (United States)

    Ma, Wanwan; Tang, Baokun; Row, Kyung Ho

    2017-08-01

    Methyltriphenylphosphonium bromide/chalcone/formic acid, a green ternary deep eutectic solvent, was applied as a functional monomer and dummy template simultaneously in the synthesis of a new molecularly imprinted polymer. Ternary deep eutectic solvent based molecularly imprinted polymers are used as a solid-phase extraction sorbent in the separation and purification of rutin and quercetin from Herba Artemisiae Scopariae combined with high-performance liquid chromatography. Fourier transform infrared spectroscopy and field-emission scanning electron microscopy were applied to characterize the deep eutectic solvent based molecularly imprinted polymers synthesized using different molar ratios of chalcone. The static and competitive adsorption tests were performed to examine the recognition ability of the molecularly imprinted polymers to rutin and quercetin. The ternary deep eutectic solvent consisting of formic acid/chalcone/methyltriphenylphosphonium bromide (1:0.05:0.5) had the best molecular recognition effect. After optimization of the washing solvents (methanol/water, 1:9) and eluting solvents (acetonitrile/acetic acid, 9:1), a reliable analytical method was developed for strong recognition towards rutin and quercetin in Herba Artemisiae Scopariae with satisfactory extraction recoveries (rutin: 92.48%, quercetin: 94.23%). Overall, the chalcone ternary deep eutectic solvent-based molecularly imprinted polymer coupled with solid-phase extraction is an effective method for the selective purification of multiple bioactive compounds in complex samples. © 2017 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  19. Bremsstrahlung emission of photons accompanying ternary fission of 252Cf

    Science.gov (United States)

    Maydanyuk, S. P.; Olkhovsky, V. S.; Mandaglio, G.; Manganaro, M.; Fazio, G.; Giardina, G.; Saccá, C.

    2011-02-01

    We present the first results on the bremsstrahlung emission of photons accompanying ternary spontaneous fission of the 252Cf nucleus. We also compare our calculations on the basis of quantum model with preliminary experimental data and find a good agreement between theory and experiment for photon energies up to 500 keV, when the α-particle emission is in presence of the field of two fission fragments of the daughter nucleus.

  20. Ternary and senary representations using DNA double-crossover tiles

    CERN Document Server

    Kim, Byeonghoon; Son, Junyoung; Kim, Junghoon; Hwang, Si Un; Dugasani, Sreekantha Reddy; Kim, Min Hyeok; Kim, Byung-Dong; Chang, Iksoo; Liu, Wing Kam; Kim, Moon Ki; Park, Sung Ha

    2016-01-01

    The information capacity of double-crossover (DX) tiles was successfully increased beyond a binary representation to higher base representations. By controlling the length and the position of DNA hairpins on the DX tile, ternary and senary (base-3 and base-6) digit representations were realized and verified by atomic force microscopy (AFM). Also, normal mode analysis (NMA) was carried out to study the mechanical characteristics of each structure.

  1. Some new quasi-twisted ternary linear codes

    Directory of Open Access Journals (Sweden)

    Rumen Daskalov

    2015-09-01

    Full Text Available Let [n, k, d]_q code be a linear code of length n, dimension k and minimum Hamming distance d over GF(q. One of the basic and most important problems in coding theory is to construct codes with best possible minimum distances. In this paper seven quasi-twisted ternary linear codes are constructed. These codes are new and improve the best known lower bounds on the minimum distance in [6].

  2. Nicral ternary alloy having improved cyclic oxidation resistance

    Science.gov (United States)

    Barrett, C. A.; Lowell, C. E.; Khan, A. S.

    1982-01-01

    NiCrAl alloys are improved by the addition of zirconium. These alloys are in the Beta or gamma/gamma' + Beta region of the ternary system. Zirconium is added in a very low amount between 0.06 and 0.20 weight percent. There is a narrow optimum zirconium level at the low value of 0.13 weight percent. Maximum resistance to cyclic oxidation is achieved when the zirconium addition is at the optimum value.

  3. Synthesis and proton conductibility of ternary germanic heteropoly acids

    Institute of Scientific and Technical Information of China (English)

    SANG Xiaoguang; WU Qingyin

    2004-01-01

    The ternary germanic heteropoly acids H5GeW11VO40·22H2O and H5GeMo11VOd0.24H2O were synthesized for the first time by the stepwise acidification and the stepwise addition of solution of the component elements. The products were characterized by ICP, IR, UV, XRD and TG-DTA. The proton conductibility and the activation energy of proton conduction of the heteropoly acids were investigated.

  4. Ternary fission of 260No in equatorial configuration

    Science.gov (United States)

    Ismail, M.; Seif, W. M.; Hashem, A. S.

    2016-10-01

    Spontaneous ternary fission is one of the observed decay modes of heavy nuclei. We systematically investigate the equatorial ternary fission of the 260No isotope. In the framework of the three-cluster model, the three-body interaction potential is calculated in terms of the folded M3Y-Reid nucleon-nucleon force and the Coulomb one. The relative orientations of the deformed heavy nuclei participating in the fragmentation process are taken into account. All possible emitted light particles with even mass numbers A = 4-52 are considered. The favored fragmentation channels are estimated as the ones characterized with peaks in the Q-value and local minima in the fragmentation potential. In the absence of nuclear deformations, the closed shell effects are found to play the key role in determining the channels of minimum fragmentation potential and the involved two heavier fragments tend to be of comparable sizes. Inclusion of nuclear deformations manifest the participation of highly deformed prolate nuclei, with large mass asymmetry, as heavy fragment partners in the estimated favored fragmentation channels. The results indicate that the equatorial ternary fission of 260No is most favored with the light emitted nuclei 4,6,8 2He and 10 4Be through the fragmentation channels 155 60Nd + 4 2He + 101 0Zr, 153 60Nd + 6 2He + 101 40Zr, 152 60Nd + 8 2He + 100 40Zr, and 152 0Nd + 10 4Be + 98 38Sr, respectively.

  5. The partially alternating ternary sum in an associative dialgebra

    CERN Document Server

    Bremner, Murray R

    2010-01-01

    The alternating ternary sum in an associative algebra, $abc - acb - bac + bca + cab - cba$, gives rise to the partially alternating ternary sum in an associative dialgebra with products $\\dashv$ and $\\vdash$ by making the argument $a$ the center of each term: $a \\dashv b \\dashv c - a \\dashv c \\dashv b - b \\vdash a \\dashv c + c \\vdash a \\dashv b + b \\vdash c \\vdash a - c \\vdash b \\vdash a$. We use computer algebra to determine the polynomial identities in degree $\\le 9$ satisfied by this new trilinear operation. In degrees 3 and 5 we obtain $[a,b,c] + [a,c,b] \\equiv 0$ and $[a,[b,c,d],e] + [a,[c,b,d],e] \\equiv 0$; these identities define a new variety of partially alternating ternary algebras. We show that there is a 49-dimensional space of multilinear identities in degree 7, and we find equivalent nonlinear identities. We use the representation theory of the symmetric group to show that there are no new identities in degree 9.

  6. Ternary Tree and Clustering Based Huffman Coding Algorithm

    Directory of Open Access Journals (Sweden)

    Pushpa R. Suri

    2010-09-01

    Full Text Available In this study, the focus was on the use of ternary tree over binary tree. Here, a new two pass Algorithm for encoding Huffman ternary tree codes was implemented. In this algorithm we tried to find out the codeword length of the symbol. Here I used the concept of Huffman encoding. Huffman encoding was a two pass problem. Here the first pass was to collect the letter frequencies. You need to use that information to create the Huffman tree. Note that char values range from -128 to 127, so you will need to cast them. I stored the data as unsigned chars to solve this problem, and then the range is 0 to 255. Open the output file and write the frequency table to it. Open the input file, read characters from it, gets the codes, and writes the encoding into the output file. Once a Huffman code has been generated, data may be encoded simply by replacing each symbol with its code. To reduce the memory size and fasten the process of finding the codeword length for a symbol in a Huffman tree, we proposed a memory efficient data structure to represent the codeword length of Huffman ternary tree. In this algorithm we tried to find out the length of the code of the symbols used in the tree.

  7. Physical properties of ternary silicide superconductors Li2XSi3 (X = Rh, Os): An ab initio study

    Science.gov (United States)

    Alam, M. A.; Zilani, M. A. K.; Parvin, F.; Hadi, M. A.

    2017-08-01

    An ab initio method, based on the plane wave pseudopotential and the generalized gradient approximation (GGA), is performed to investigate the physical properties such as structural, elastic, electronic and bonding properties of newly synthesized Li2RhSi3 and predicted Li2OsSi3 ternary silicide superconductors for the first time. Both of these compounds are mechanically stable and are brittle in nature. They also have good machinability. Electronic band structures reveal that these compounds have metallic characteristics. They possess complex bonding nature (metallic, covalent and ionic). According to theoretical Vickers hardness, Li2RhSi3 is softer than Li2OsSi3.

  8. Comparison of actual vs synthesized ternary phase diagrams for solutes of cryobiological interest☆

    OpenAIRE

    F W Kleinhans; Mazur, Peter

    2007-01-01

    Phase diagrams are of great utility in cryobiology, especially those consisting of a cryoprotective agent (CPA) dissolved in a physiological salt solution. These ternary phase diagrams consist of plots of the freezing points of increasing concentrations of solutions of cryoprotective agents (CPA) plus NaCl. Because they are time-consuming to generate, ternary diagrams are only available for a small number of CPA's. We wanted to determine whether accurate ternary phase diagrams could be synthe...

  9. Comparison Of Modified Dual Ternary Indexing And Multi-Key Hashing Algorithms For Music Information Retrieval

    OpenAIRE

    2010-01-01

    In this work we have compared two indexing algorithms that have been used to index and retrieve Carnatic music songs. We have compared a modified algorithm of the Dual ternary indexing algorithm for music indexing and retrieval with the multi-key hashing indexing algorithm proposed by us. The modification in the dual ternary algorithm was essential to handle variable length query phrase and to accommodate features specific to Carnatic music. The dual ternary indexing algorithm is ...

  10. A Thermodynamic Approach to Predict Formation Enthalpies of Ternary Systems Based on Miedema's Model

    Science.gov (United States)

    Mousavi, Mahbubeh Sadat; Abbasi, Roozbeh; Kashani-Bozorg, Seyed Farshid

    2016-07-01

    A novel modification to the thermodynamic semi-empirical Miedema's model has been made in order to provide more precise estimations of formation enthalpy in ternary alloys. The original Miedema's model was modified for ternary systems based on surface concentration function revisions. The results predicted by the present model were found to be in excellent agreement with the available experimental data of over 150 ternary intermetallic compounds. The novel proposed model is capable of predicting formation enthalpies of ternary intermetallics with small discrepancies of ≤20 kJ/mol as well as providing reliable enthalpy variations.

  11. Carbometalates. Intermediate phases in the ternary systems RE-T-C (RE = Y, La, Gd-Er; T = Cr, Fe, Ru)

    Energy Technology Data Exchange (ETDEWEB)

    Davaasuren, Bambar

    2010-07-01

    The main motivation of this work was the preparation and characterization of novel compounds in the ternary systems RE-T-C with T = Cr, Fe and Ru with a special focus on compounds containing C{sub 2}{sup n-} and C{sub 3}{sup m-} or mixed C and C{sub 2}{sup n-} as structural units. This would allow to investigate the applicability of the concept of complex anions to this class of materials.

  12. OPTIMIZED LOCAL TERNARY PATTERNS: A NEW TEXTURE MODEL WITH SET OF OPTIMAL PATTERNS FOR TEXTURE ANALYSIS

    Directory of Open Access Journals (Sweden)

    G. Madasamy Raja

    2013-01-01

    Full Text Available Texture analysis is one of the important as well as useful tasks in image processing applications. Many texture models have been developed over the past few years and Local Binary Patterns (LBP is one of the simple and efficient approach among them. A number of extensions to the LBP method have been also presented but the problem remains challenging in feature vector generation and comparison. As textures are oriented and scaled differently, a texture model should effectively handle grey-scale variation, rotation variation, illumination variation and noise. The length of the feature vector in a texture model also plays an important role in deciding the time complexity of the texture analysis. This study proposes a new texture model, called Optimized Local Ternary Patterns (OLTP in the spatial methods of texture analysis. The proposed texture model is based on Local Ternary Patterns (LTP, which in turn is based on LBP. A new concept called “Level of Optimality” to select the optimal set of patterns is discussed in this study. This proposed texture model uses only optimal patterns to extract the textural information from the digital images and thereby reducing the length of the feature vector. This proposed model is robust to image rotation, grey-scale transformation, histogram equalization and noise. The results are compared with other widely used texture models by applying classification tests to variety of texture images from the standard Brodatz texture database. Experimental results prove that the proposed texture model is robust to grey-scale variation, image rotation, histogram equalization and noise. Experimental results also show that the proposed texture model improves the classification accuracy and the speed of the classification process. In all tested tasks, the proposed method outperforms the earlier methods.

  13. Boron-Based Hydrogen Storage: Ternary Borides and Beyond

    Energy Technology Data Exchange (ETDEWEB)

    Vajo, John

    2016-09-22

    DOE continues to seek reversible solid-state hydrogen materials with hydrogen densities of ³11 wt% and ³80 g/L that can deliver hydrogen and be recharged at moderate temperatures (£100 °C) and pressures (£100 bar) enabling incorporation into hydrogen storage systems suitable for transportation applications. Boron-based hydrogen storage materials have the potential to meet the density requirements given boron’s low atomic weight, high chemical valance, and versatile chemistry. However, the rates of hydrogen exchange in boron based compounds are thus far much too slow for practical applications. Although contributing to the high hydrogen densities, the high valance of boron also leads to slow rates of hydrogen exchange due to extensive boron-boron atom rearrangements during hydrogen cycling. This rearrangement often leads to multiple solid phases occurring over hydrogen release and recharge cycles. These phases must nucleate and react with each other across solid-solid phase boundaries leading to energy barriers that slow the rates of hydrogen exchange. This project sought to overcome the slow rates of hydrogen exchange in boron-based hydrogen storage materials by minimizing the number of solid phases and the boron atom rearrangement over a hydrogen release and recharge cycle. Two novel approaches were explored: 1) developing matched pairs of ternary borides and mixed-metal borohydrides that could exchange hydrogen with only one hydrogenated phase (the mixed-metal borohydride) and only one dehydrogenated phase (the ternary boride); and 2) developing boranes that could release hydrogen by being lithiated using lithium hydride with no boron-boron atom rearrangement. For the first approach, possible pairs of ternary borides and mixed-metal borohydrides based on Mg with various first row transition metals were investigated both experimentally and theoretically. In particular, the Mg/Mn ternary boride and mixed-metal borohydride were found to be a suitable pair and

  14. Ternary fission of {sup 260}No in equatorial configuration

    Energy Technology Data Exchange (ETDEWEB)

    Ismail, M.; Seif, W.M.; Hashem, A.S. [Faculty of Science, Department of Physics, Cairo University, Giza (Egypt)

    2016-10-15

    Spontaneous ternary fission is one of the observed decay modes of heavy nuclei. We systematically investigate the equatorial ternary fission of the {sup 260}No isotope. In the framework of the three-cluster model, the three-body interaction potential is calculated in terms of the folded M3Y-Reid nucleon-nucleon force and the Coulomb one. The relative orientations of the deformed heavy nuclei participating in the fragmentation process are taken into account. All possible emitted light particles with even mass numbers A = 4-52 are considered. The favored fragmentation channels are estimated as the ones characterized with peaks in the Q-value and local minima in the fragmentation potential. In the absence of nuclear deformations, the closed shell effects are found to play the key role in determining the channels of minimum fragmentation potential and the involved two heavier fragments tend to be of comparable sizes. Inclusion of nuclear deformations manifest the participation of highly deformed prolate nuclei, with large mass asymmetry, as heavy fragment partners in the estimated favored fragmentation channels. The results indicate that the equatorial ternary fission of {sup 260}No is most favored with the light emitted nuclei {sup 4,6,8}{sub 2}He and {sup 10}{sub 4}Be through the fragmentation channels {sup 155}{sub 60}Nd + {sup 4}{sub 2}He + {sup 101}{sub 40}Zr, {sup 153}{sub 60}Nd + {sup 6}{sub 2}He + {sup 101}{sub 40}Zr, {sup 152}{sub 60}Nd + {sup 8}{sub 2}He + {sup 100}{sub 40}Zr, and {sup 152}{sub 60}Nd + {sup 10}{sub 4}Be + {sup 98}{sub 38}Sr, respectively. (orig.)

  15. Crystal Growth of Ternary Compound Semiconductors in Low Gravity Environment

    Science.gov (United States)

    Su, Ching-Hua

    2014-01-01

    A low gravity material experiment will be performed in the Material Science Research Rack (MSRR) on International Space Station (ISS). There are two sections of the flight experiment: (I) crystal growth of ZnSe and related ternary compounds, such as ZnSeS and ZnSeTe, by physical vapor transport (PVT) and (II) melt growth of CdZnTe by directional solidification. The main objective of the project is to determine the relative contributions of gravity-driven fluid flows to the compositional distribution, incorporation of impurities and defects, and deviation from stoichiometry observed in the grown crystals as results of buoyancy-driven convection and growth interface fluctuations caused by irregular fluid-flows on Earth. The investigation consists of extensive ground-based experimental and theoretical research efforts and concurrent flight experimentation. This talk will focus on the ground-based studies on the PVT crystal growth of ZnSe and related ternary compounds. The objectives of the ground-based studies are (1) obtain the experimental data and conduct the analyses required to define the optimum growth parameters for the flight experiments, (2) perfect various characterization techniques to establish the standard procedure for material characterization, (3) quantitatively establish the characteristics of the crystals grown on Earth as a basis for subsequent comparative evaluations of the crystals grown in a low-gravity environment and (4) develop theoretical and analytical methods required for such evaluations. ZnSe and related ternary compounds have been grown by vapor transport technique with real time in-situ non-invasive monitoring techniques. The grown crystals have been characterized extensively by various techniques to correlate the grown crystal properties with the growth conditions.

  16. Combined statistical and dynamical model of ternary nuclear fission

    Science.gov (United States)

    Lestone, J. P.

    2004-08-01

    The statistical theory of particle evaporation from hot compound nuclei can be used to calculate the probability that particles are evaporated from the nuclear surface with not enough energy to surmount the Coulomb barrier. These quasievaporated particles exist between the nuclear surface and the Coulomb barrier for a short period of time before returning to the nuclear fluid. Occasionally, a quasievaporated charged particle emitted into the region surrounding the pre-scission neck material, fails to be reabsorbed by either of the main fragments as they accelerate away from each other after scission. This new particle emission mechanism can be used to explain many of the properties of ternary nuclear fission.

  17. ESTIMATING ERROR BOUNDS FOR TERNARY SUBDIVISION CURVES/SURFACES

    Institute of Scientific and Technical Information of China (English)

    Ghulam Mustafa; Jiansong Deng

    2007-01-01

    We estimate error bounds between ternary subdivision curves/surfaces and their control polygons after k-fold subdivision in terms of the maximal differences of the initial control point sequences and constants that depend on the subdivision mask. The bound is independent of the process of subdivision and can be evaluated without recursive subdivision.Our technique is independent of parametrization therefore it can be easily and efficiently implemented. This is useful and important for pre-computing the error bounds of subdivision curves/surfaces in advance in many engineering applications such as surface/surface intersection, mesh generation, NC machining, surface rendering and so on.

  18. Electroless ternary NiCeP coatings: Preparation and characterisation

    Energy Technology Data Exchange (ETDEWEB)

    Balaraju, J.N., E-mail: jnbalraj@nal.res.in [Surface Engineering Division, CSIR National Aerospace Laboratories, Post Bag No. 1779 Bangalore 560017, Karnataka (India); Chembath, Manju [Surface Engineering Division, CSIR National Aerospace Laboratories, Post Bag No. 1779 Bangalore 560017, Karnataka (India)

    2012-10-01

    Highlights: Black-Right-Pointing-Pointer Rare earth element (Ce) has been successfully codeposited in NiP matrix. Black-Right-Pointing-Pointer Surface analysis carried out by XPS showed that the Ce is present in +3 and +4 oxidation state. Black-Right-Pointing-Pointer Palladium stability test indicated that the Ce salts in electroless nickel bath has reduced the stability. Black-Right-Pointing-Pointer Cerium codeposition in NiP matrix has increased the microhardness both in as-plated and annealed conditions. Black-Right-Pointing-Pointer Higher thermal stability has been obtained by Ce incorporation. - Abstract: Electroless ternary NiCeP deposits were prepared from alkaline citrate bath containing nickel sulphate, cerium chloride and sodium hypophosphite. Concentration of rare earth cerium was varied from 1 to 2 g/L to obtain ternary deposits containing variable Ce and P contents. The influence of cerium on the deposit properties was analysed. The deposit exhibited a maximum cerium content of 6.2 {+-} 0.1 wt.% when the cerium chloride concentration was 2 g/L. The result of the Pd stability test showed that the stability of the bath was reduced due to Ce salt addition. The microhardness measurements made on both as-plated and heat treated samples exhibited a peak hardness of 1006 {+-} 11 VHN for cerium concentration of 1.5 g/L. The concept of kinetic strength analysis was proved to be applicable only for binary and not for ternary alloys due to multistep deposition mechanism with different kinetic energies. X-ray diffraction (XRD) patterns of as-plated and heat treated samples revealed peaks corresponding to Ni (1 1 1) and nickel phosphide (Ni{sub 3}P). Higher amount of Ce incorporation in NiP matrix increased the crystallisation temperature of the deposit which could be due to the suppression of nickel crystallisation prior to Ni{sub 3}P compound formation and thus increasing the activation energy for the formation of stable phases. Surface compositional analysis

  19. Superconductivity in sodium-hydrogen-C{sub 60} ternary compound

    Energy Technology Data Exchange (ETDEWEB)

    Imaeda, K. [Institute for Molecular Science, Okazaki (Japan); Kroeber, J. [Institute for Molecular Science, Okazaki (Japan); Inokuchi, H. [Institute for Molecular Science, Okazaki (Japan); Yonehara, Y. [Kumamoto Univ. (Japan). Dept. of Chem.; Ichimura, K. [Kumamoto Univ. (Japan). Dept. of Chem.

    1997-02-15

    The magnetic properties of the superconducting sodium-hydrogen-C{sub 60} ternary compound have been investigated by means of SQUID and ESR. The superconducting parameters (the penetration depth {lambda} and the coherence length {xi}) are estimated to be {lambda} = 2800 A and {xi} = 38 A using H{sub c1}(0) = 90 G and H{sub c2}(0) = 22 T. The spin susceptibility and the ESR linewidth decrease sharply below {proportional_to}250 K, suggesting the presence of some phase transition. (orig.)

  20. Plutonium microstructures. Part 2. Binary and ternary alloys

    Energy Technology Data Exchange (ETDEWEB)

    Cramer, E.M.; Bergin, J.B.

    1983-12-01

    This report is the second of three parts that exhibit illustrations of inclusions in plutonium metal from inherent and tramp impurities, of intermetallic and nonmetallic constituents from alloy additions, and of the effects of thermal and mechanical treatments. This part includes illustrations of the microstructures in binary cast alloys and a few selected ternary alloys that result from measured additions of diluent elements, and of the microconstituents that are characteristic of phase fields in extended alloy systems. Microhardness data are given and the etchant used in the preparation of each sample is described.

  1. Infrared target recognition based on improved joint local ternary pattern

    Science.gov (United States)

    Sun, Junding; Wu, Xiaosheng

    2016-05-01

    This paper presents a simple, efficient, yet robust approach, named joint orthogonal combination of local ternary pattern, for automatic forward-looking infrared target recognition. It gives more advantages to describe the macroscopic textures and microscopic textures by fusing variety of scales than the traditional LBP-based methods. In addition, it can effectively reduce the feature dimensionality. Further, the rotation invariant and uniform scheme, the robust LTP, and soft concave-convex partition are introduced to enhance its discriminative power. Experimental results demonstrate that the proposed method can achieve competitive results compared with the state-of-the-art methods.

  2. Representations of Clifford algebras of ternary quartic forms

    CERN Document Server

    Coskun, Emer; Mustopa, Yusuf

    2011-01-01

    Given a nondegenerate ternary form $f=f(x_1,x_2,x_3)$ of degree 4 over an algebraically closed field of characteristic zero, we use the geometry of K3 surfaces to construct a certain positive-dimensional family of irreducible representations of the generalized Clifford algebra associated to $f.$ From this we obtain the existence of linear Pfaffian representations of the quartic surface $X_f=\\{w^4=f(x_1,x_2,x_3)\\},$ as well as information on the Brill-Noether theory of a general smooth curve in the linear system $|\\mathcal{O}_{X_f}(3)|.$

  3. Modeling adsorption of binary and ternary mixtures on microporous media

    DEFF Research Database (Denmark)

    Monsalvo, Matias Alfonso; Shapiro, Alexander

    2007-01-01

    The goal of this work is to analyze the adsorption of binary and ternary mixtures on the basis of the multicomponent potential theory of adsorption (MPTA). In the MPTA, the adsorbate is considered as a segregated mixture in the external potential field emitted by the solid adsorbent. This makes...... it possible using the same equation of state to describe the thermodynamic properties of the segregated and the bulk phases. For comparison, we also used the ideal adsorbed solution theory (IAST) to describe adsorption equilibria. The main advantage of these two models is their capabilities to predict...

  4. Ternary Reversible Logic Synthesis Algorithm with Minimum Chaos Degree%基于最小混乱度的三值可逆逻辑综合算法

    Institute of Scientific and Technical Information of China (English)

    徐明强; 管致锦; 张海豹

    2013-01-01

    Ternary reversible logic synthesis is the extension and expansion of reversible logic synthesis .In order to simplify the reversible network and improve the generality of ternary reversible logic gate ,the effective value of controlling bits of the exist-ing ternary reversible controlled gates can be extended to any of 0 ,1 and 2 .And on the basis of that ,a ternary reversible logic syn-thesis algorithm with minimum chaos degree is proposed .The algorithm is used to compute the relative chaos degree and absolute chaos degree of each variable in truth table under ternary logic system ,according to the reversible function .As one reversible logic gate is selected ,the principle of minimal chaos degree in ternary reversible logic synthesis should be followed until the relative chaos degree and absolute chaos degree of each variable in truth table decrease to 0 ,which means the synthesis has been finished ,and the reversible network can be derived .The time complexity for the algorithm is O ( n2 × 3 n ) ,and its space complexity is O ( n × 3 n ) . The experimental results show that the average number of gates is less than the existing algorithms as known .%三值可逆逻辑综合是可逆逻辑综合的延伸和扩展.为了简化可逆网络,提高三值可逆逻辑门的通用性,对现有三值可逆控制门控制位的生效值扩展为0、1和2.在此基础上提出了基于最小混乱度原则的三值可逆逻辑综合算法.该算法根据三值可逆函数计算其对应真值表中每个变量的相对混乱度和绝对混乱度,以最小混乱度原则选取三值可逆逻辑门,直至真值表中的每个变量的混乱度为零,得到三值可逆网络.该算法的时间复杂度为 O(n2×3n ),空间复杂度为 O(n ×3n).实验结果表明,与现有已知算法对比,平均门数更少.

  5. Liquid-liquid equilibria for binary and ternary polymer solutions with PC-SAFT

    DEFF Research Database (Denmark)

    Lindvig, Thomas; Michelsen, Michael Locht; Kontogeorgis, Georgios

    2004-01-01

    Two algorithms for evaluating liquid-liquid equilibria (LLE) for binary and ternary polymer solutions are presented. The binary algorithm provides the temperature versus concentration cloud-point curve at fixed pressure, whereas the ternary algorithm provides component 1 versus component 2...

  6. INTERVAL-VALUED INTUITIONISTIC FUZZY BI-IDEALS IN TERNARY SEMIRINGS

    Directory of Open Access Journals (Sweden)

    D. KRISHNASWAMY

    2016-04-01

    Full Text Available In this paper we introduce the notions of interval-valued fuzzy bi-ideal, interval-valued anti fuzzy bi-ideal and interval-valued intuitionistic fuzzy bi-ideal in ternary semirings and some of the basic properties of these ideals are investigated. We also introduce normal interval-valued intuitionistic fuzzy ideals in ternary semirings.

  7. Fluorescence of complexes of Eu( Ⅱ ) with aromatic carboxylic acid-1, 1O-phenanthroline

    Institute of Scientific and Technical Information of China (English)

    2001-01-01

    The 1, 10-phenanthroline-aromatic carboxylic acid (benzoic acid and o-phthalic acid) binary and ternary complexes of europium were synthesized. The fluorescence and FT-IR spectroscopy, elemental analysis, UV spectroscopic studies on these complexes were also performed. These complexes can emit strong red fluorescence of Eu( m ) excited by UV light. At the same excited wavelength, the fluorescence spectra of the complexes were also studied. The results indi cated that the fluorescence intensities of ternary complexes are stronger than that of binary complexes. The reason is that phenanthroline has higher electron density and higher orbit scope in the conjugated system and consequently an easier ener gy transfer to the europium ion, which makes the fluorescence intensity of ternary complexes be stronger than that of bi nary complexes.

  8. A novel method based on selective laser sintering for preparing high-performance carbon fibres/polyamide12/epoxy ternary composites.

    Science.gov (United States)

    Zhu, Wei; Yan, Chunze; Shi, Yunsong; Wen, Shifeng; Liu, Jie; Wei, Qingsong; Shi, Yusheng

    2016-09-21

    A novel method based on selective laser sintering (SLS) process is proposed for the first time to prepare complex and high-performance carbon fibres/polyamide12/epoxy (CF/PA12/EP) ternary composites. The procedures are briefly described as follows: prepare polyamide12 (PA12) coated carbon fibre (CF) composite powder; build porous green parts by SLS; infiltrate the green parts with high-performance thermosetting epoxy (EP) resin; and finally cure the resin at high temperature. The obtained composites are a ternary composite system consisting of the matrix of novolac EP resin, the reinforcement of CFs and the transition thin layer of PA12 with a thickness of 595 nm. The SEM images and micro-CT analysis prove that the ternary system is a three-dimensional co-continuous structure and the reinforcement of CFs are well dispersed in the matrix of EP with the volume fraction of 31%. Mechanical tests show that the composites fabricated by this method yield an ultimate tensile strength of 101.03 MPa and a flexural strength of 153.43 MPa, which are higher than those of most of the previously reported SLS materials. Therefore, the process proposed in this paper shows great potential for manufacturing complex, lightweight and high-performance CF reinforced composite components in aerospace, automotive industries and other areas.

  9. A novel method based on selective laser sintering for preparing high-performance carbon fibres/polyamide12/epoxy ternary composites

    Science.gov (United States)

    Zhu, Wei; Yan, Chunze; Shi, Yunsong; Wen, Shifeng; Liu, Jie; Wei, Qingsong; Shi, Yusheng

    2016-09-01

    A novel method based on selective laser sintering (SLS) process is proposed for the first time to prepare complex and high-performance carbon fibres/polyamide12/epoxy (CF/PA12/EP) ternary composites. The procedures are briefly described as follows: prepare polyamide12 (PA12) coated carbon fibre (CF) composite powder; build porous green parts by SLS; infiltrate the green parts with high-performance thermosetting epoxy (EP) resin; and finally cure the resin at high temperature. The obtained composites are a ternary composite system consisting of the matrix of novolac EP resin, the reinforcement of CFs and the transition thin layer of PA12 with a thickness of 595 nm. The SEM images and micro-CT analysis prove that the ternary system is a three-dimensional co-continuous structure and the reinforcement of CFs are well dispersed in the matrix of EP with the volume fraction of 31%. Mechanical tests show that the composites fabricated by this method yield an ultimate tensile strength of 101.03 MPa and a flexural strength of 153.43 MPa, which are higher than those of most of the previously reported SLS materials. Therefore, the process proposed in this paper shows great potential for manufacturing complex, lightweight and high-performance CF reinforced composite components in aerospace, automotive industries and other areas.

  10. A novel method based on selective laser sintering for preparing high-performance carbon fibres/polyamide12/epoxy ternary composites

    Science.gov (United States)

    Zhu, Wei; Yan, Chunze; Shi, Yunsong; Wen, Shifeng; Liu, Jie; Wei, Qingsong; Shi, Yusheng

    2016-01-01

    A novel method based on selective laser sintering (SLS) process is proposed for the first time to prepare complex and high-performance carbon fibres/polyamide12/epoxy (CF/PA12/EP) ternary composites. The procedures are briefly described as follows: prepare polyamide12 (PA12) coated carbon fibre (CF) composite powder; build porous green parts by SLS; infiltrate the green parts with high-performance thermosetting epoxy (EP) resin; and finally cure the resin at high temperature. The obtained composites are a ternary composite system consisting of the matrix of novolac EP resin, the reinforcement of CFs and the transition thin layer of PA12 with a thickness of 595 nm. The SEM images and micro-CT analysis prove that the ternary system is a three-dimensional co-continuous structure and the reinforcement of CFs are well dispersed in the matrix of EP with the volume fraction of 31%. Mechanical tests show that the composites fabricated by this method yield an ultimate tensile strength of 101.03 MPa and a flexural strength of 153.43 MPa, which are higher than those of most of the previously reported SLS materials. Therefore, the process proposed in this paper shows great potential for manufacturing complex, lightweight and high-performance CF reinforced composite components in aerospace, automotive industries and other areas. PMID:27650254

  11. 辛三代数的Frattini子代数%THE FRATTINI SUBALGEBRA OF SYMPLECTIC TERNARY ALGEBRAS

    Institute of Scientific and Technical Information of China (English)

    白喜梅; 白瑞蒲

    2012-01-01

    This paper studies the Prattini subalgebra of symplectic ternary algebras and elementary symplectic ternary algebras. By using the properties of the Prattini subalgebra of symplectic ternary algebras and elementary symplectic ternary algebras, the non-imbedding theorem of symplectic ternary algebras is obtained, which generalizes the result of Prattini subsystem of Lie triple systems.%本文研究了辛三代数的Frattini子代数和基本辛三代数的问题.利用Frattini子代数和基本辛三代数的性质,得到了辛三代数的非嵌入定理,从而推广了李三系中关于Frattini子系的结果.

  12. Algebras with ternary law of composition combining Z_2 and Z_3 gradings

    CERN Document Server

    Abramov, V; Liivapuu, O

    2015-01-01

    In the present article we investigate the possibility of combining the usual Grassmann algebras with their ternary Z_3-graded counterpart, thus creating a more general algebra with coexisting quadratic and cubic constitutive relations. We recall the classification of ternary and cubic algebras according to the symmetry properties of ternary products under the action of the S_3 permutation group. Instead of only two kinds of binary algebras, symmetric or antisymmetric, here we get four different generalizations of each of these two cases. Then we study a particular case of algebras generated by two types of variables, the generators of Grassmann algebra and generators of ternary analog of Grassmann algebra, satisfying quadratic and cubic relations respectively, i.e. the generators of Grassmann algebra anticommute and a triple product of any three generators of a ternary analog of Grassmann algebra is equal to cyclic permutation of generators in this product multiplied by a primitive 3rd root of unity. The inva...

  13. Decision tree method applied to computerized prediction of ternary intermetallic compounds

    Institute of Scientific and Technical Information of China (English)

    2001-01-01

    Decision tree method and atomic parameters were used to find the regularities of the formation of ternary intermetallic compounds in alloy systems. The criteria of formation can be expressed by a group of inequalities with two kinds of atomic parameters Zl (number of valence electrons in the atom of constituent element) and Ri/Rj (ratio of the atomic radius of constituent element i and j) as independent variables. The data of 2238 known ternary alloy systems were used to extract the empirical rules governing the formation of ternary intermetallic compounds, and the facts of ternary compound formation of other 1334 alloy systems were used as samples to test the reliability of the empirical criteria found. The rate of correctness of prediction was found to be nearly 95%. An expert system for ternary intermetallic compound formation was built and some prediction results of the expert system were confirmed.

  14. On the Dissolution Behavior of Sulfur in Ternary Silicate Slags

    Science.gov (United States)

    Kang, Youn-Bae; Park, Joo Hyun

    2011-12-01

    Sulfur dissolution behavior, in terms of sulfide capacity ( C S), in ternary silicate slags (molten oxide slags composed of MO - NO - SiO2, where M and N are Ca, Mn, Fe, and Mg), is discussed based on available experimental data. Composition dependence of the sulfur dissolution, at least in the dilute region of sulfur, may be explained by taking into account the cation-anion first-nearest-neighbor (FNN) interaction (stability of sulfide) and the cation-cation second-nearest-neighbor (SNN) interaction over O anion (oxygen proportions in silicate slags). When the Gibbs energy of a reciprocal reaction MO + NS = MS + NO is positive, the sulfide capacity of slags with virtually no SiO2 or low SiO2 concentration decreases as the concentration of MO increases. However, in some slags, as SiO2 concentration increases, replacing NO by MO at a constant SiO2 concentration may increase sulfide capacity when the basicity of NO is less than that of MO. This phenomenon is observed as rotation of iso- C S lines in ternary silicate slags, and it is explained by simultaneous consideration of the stability of sulfide and oxygen proportions in the silicate slags. It is suggested that a solution model for the prediction of sulfide capacity should be based on the actual dissolution mechanism of sulfur rather than on the simple empirical correlation.

  15. All possible ternary fragmentations of Cf252 in collinear configuration

    Science.gov (United States)

    Manimaran, K.; Balasubramaniam, M.

    2011-03-01

    All possible ternary fragmentations in fission of Cf252 are studied in collinear configuration within a spherical approximation using the recently proposed “three cluster model.” The potential energy surface of collinear configuration exhibits a strong valley around Ca48 and its neighboring nuclei Ca50, Ti54, and Cr60. Such strong minima are not seen in the potential energy surface of an equatorial configuration. As a consequence of strong minima in the potential, the overall relative yield is higher for the ternary fragmentation with Ca48, Ca50, Ti54, Cr60, and Ge82 as the third fragment. The results of potential energy and relative yield calculations reveal that collinear configuration increases the probability of emission of heavy fragments like Ca48 (doubly magic nucleus) and its neighboring nuclei as the third fragment. The obtained results indicate that the collinear configuration is the preferred configuration for intermediate nuclei (Ca48, Ca50, Ti54, and Cr60) as the third fragment in particle accompanied fission while the equatorial configuration may be a preferred configuration for light nuclei (He4, Be10) as the third fragment.

  16. Ternary fission of 260No in collinear configuration

    Science.gov (United States)

    Ismail, M.; Seif, W. M.; Hashem, A. S.; Botros, M. M.; Abdul-Magead, I. A. M.

    2016-09-01

    We investigate the collinear ternary fission of the 260No isotope. The calculations are performed in the framework of the three cluster model for all possible accompanied light particles of even mass numbers A = 4 - 52. The folding nuclear and Coulomb interaction potentials are used, based on the M3Y-Reid nucleon-nucleon force for the nuclear part. The deformation of the involved fragments and their relative orientations with respect to each other inside the fissioning nuclei are considered. Among all possible fragmentation channels, the suggested most probable channels are indicated as the ones showing a peak in the Q-value and a local minimum in the fragmentation potential, with respect to the mass and charge asymmetries. The indicated favored fragmentation channels from the approximate spherical calculations and those obtained after considering the deformations of the produced fragments are discussed in detail. In addition to the preferred heavy fragments of closed shells, favored prolate ones of high deformations appear when the nuclear deformations are taken into account. Among indicated fifty six favored channels, a collinear ternary fission of the 260No isotope is indicated to be most favored through the fragmentation channels of 15058Ce+410Be+40100Zr,60152Nd+412Be+3896Sr,58150Ce+614C+3896Sr,58148Ce+616C+3896Sr,54140Xe+822O+4098Zr,42106Mo+1848Ar+42106Mo and 41104Nb+2052Ca+41104Nb.

  17. Genetic Synthesis of New Reversible/Quantum Ternary Comparator

    Directory of Open Access Journals (Sweden)

    DEIBUK, V.

    2015-08-01

    Full Text Available Methods of quantum/reversible logic synthesis are based on the use of the binary nature of quantum computing. However, multiple-valued logic is a promising choice for future quantum computer technology due to a number of advantages over binary circuits. In this paper we have developed a synthesis of ternary reversible circuits based on Muthukrishnan-Stroud gates using a genetic algorithm. The method of coding chromosome is presented, and well-grounded choice of algorithm parameters allowed obtaining better circuit schemes of one- and n-qutrit ternary comparators compared with other methods. These parameters are quantum cost of received reversible devices, delay time and number of constant input (ancilla lines. Proposed implementation of the genetic algorithm has led to reducing of the device delay time and the number of ancilla qutrits to 1 and 2n-1 for one- and n-qutrits full comparators, respectively. For designing of n-qutrit comparator we have introduced a complementary device which compares output functions of 1-qutrit comparators.

  18. Formation of ternary Mg–Cu–Dy bulk metallic glasses

    Indian Academy of Sciences (India)

    X F Wu; Y Kang; F F Wu; K Q Qiu; L K Meng

    2011-12-01

    The glass-forming ability (GFA) of ternary Mg–Cu–Dy alloys was systematically investigated by using differential scanning calorimetry (DSC) and X-ray diffractometry (XRD) techniques. The results showed that a series of ternary Mg–Cu–Dy bulk metallic glasses (BGMs) with a diameter of 4–8 mm were successfully fabricated in the system with conventional Cu-mold casting method. Mg55Cu32Dy13, Mg60Cu27Dy13, Mg65Cu25Dy10 and Mg70Cu17Dy13 BMGs exhibit a clear glass transition, a broad supercooled liquid region and different crystallization and melting behaviours. They have supercooled liquid region ($\\Delta T_{x}$) from 41 K to 65 K, reduced glass transition temperature ($T_{rg}$) from 0.5363 to 0.5974 and parameter from 0.4038 to 0.4136. The shows a relatively good agreement with the GFA of the BGMs. On the other hand, a high fracture compressive strength of 624 MPa was obtained for Mg60Cu27Dy13 BMG.

  19. Thermodynamic Modeling of the Al-Cr-Mn Ternary System

    Science.gov (United States)

    Cui, Senlin; Jung, In-Ho

    2017-03-01

    The phase diagram information available in the literature on the Al-Cr-Mn system was comprehensively evaluated and optimized for the first time to obtain a set of Gibbs energies of all the solid and liquid phases in the Al-Cr-Mn system. The Modified Quasi-chemical Model (MQM) was utilized to describe the Gibbs energy of the liquid phase of the Al-Cr-Mn system. The Compound Energy Formalism (CEF) was used to model the solid solution phases. A revision of the Al-Mn system was simultaneously conducted to consider the γ_H (Al8Mn5) phase. The liquid Cr-Mn phase was also remodeled using the Modified Quasi-chemical Model (MQM) to obtain a consistent description of the ternary Al-Cr-Mn liquid phase. Accurate description of the phase diagram of the entire Al-Cr-Mn system was obtained from the thermodynamic models with optimized parameters in the present study, and the model parameters can be used to predict the thermodynamic properties of the ternary system.

  20. Breast mass classification on mammograms using radial local ternary patterns.

    Science.gov (United States)

    Muramatsu, Chisako; Hara, Takeshi; Endo, Tokiko; Fujita, Hiroshi

    2016-05-01

    Textural features can be useful in differentiating between benign and malignant breast lesions on mammograms. Unlike previous computerized schemes, which relied largely on shape and margin features based on manual contours of masses, textural features can be determined from regions of interest (ROIs) without precise lesion segmentation. In this study, therefore, we investigated an ROI-based feature, namely, radial local ternary patterns (RLTP), which takes into account the direction of edge patterns with respect to the center of masses for classification of ROIs for benign and malignant masses. Using an artificial neural network (ANN), support vector machine (SVM) and random forest (RF) classifiers, the classification abilities of RLTP were compared with those of the regular local ternary patterns (LTP), rotation invariant uniform (RIU2) LTP, texture features based on the gray level co-occurrence matrix (GLCM), and wavelet features. The performance was evaluated with 376 ROIs including 181 malignant and 195 benign masses. The highest areas under the receiver operating characteristic curves among three classifiers were 0.90, 0.77, 0.78, 0.86, and 0.83 for RLTP, LTP, RIU2-LTP, GLCM, and wavelet features, respectively. The results indicate the usefulness of the proposed texture features for distinguishing between benign and malignant lesions and the superiority of the radial patterns compared with the conventional rotation invariant patterns.

  1. Predicting toxicity of aromatic ternary mixtures to algae

    Institute of Scientific and Technical Information of China (English)

    LU GuangHua; WANG Chao; WANG PeiFang; YANG ChengZhi

    2009-01-01

    Aquatic ecosystems are often polluted with more than one type of contaminant, and information on the combined toxic effects of mixed pollutants on aquatic organisms is scarce at present. Acute toxicity of aromatic compounds and their ternary mixtures to the alga (Scenedesmus obliquus) was determined by the algae growth inhibition test. The median effective concentration (EC_(50)) value for a single aromatic compound and EC_(50mix) values for mixtures were obtained, the logarithm of n-octanol/water partition coefficient (logP_(mix)) and the frontier orbital energy gap (△E_(mix) for mixtures were calculated. Based on the quantitative structure-activity relationship model for single chemical toxicity log(1/EC_(50)) =0.426logP-1.150△E+12.61 (n=15, R~2=0.917 and Q~2=0.878), the following two-descriptor model was developed for the ternary mixture toxicity of aromatic compounds: log(1/EC_(50mix))=O.68210gP_(mix)-O.367△E_(mix)+ 4.971 (n=44, R~2-0.869 and Q~2=0.843). This model can be used to predict the combined toxicity of mixtures containing toxicants with different mechanisms of action.

  2. On a Class of Ternary Inclusion-Exclusion Polynomials

    CERN Document Server

    Bachman, Gennady

    2010-01-01

    A ternary inclusion-exclusion polynomial is a polynomial of the form \\[ Q_{{p,q,r}}=\\frac{(z^{pqr}-1)(z^p-1)(z^q-1)(z^r-1)} {(z^{pq}-1)(z^{qr}-1)(z^{rp}-1)(z-1)}, \\] where $p$, $q$, and $r$ are integers $\\ge3$ and relatively prime in pairs. This class of polynomials contains, as its principle subclass, the ternary cyclotomic polynomials corresponding to restricting $p$, $q$, and $r$ to be distinct odd prime numbers. Our object here is to continue the investigation of the relationship between the coefficients of $Q_{{p,q,r}}$ and $Q_{{p,q,s}}$, with $r\\equiv s\\pmod{pq}$. More specifically, we consider the case where $1\\le s<\\max(p,q)

  3. Multi-texture local ternary pattern for face recognition

    Science.gov (United States)

    Essa, Almabrok; Asari, Vijayan

    2017-05-01

    In imagery and pattern analysis domain a variety of descriptors have been proposed and employed for different computer vision applications like face detection and recognition. Many of them are affected under different conditions during the image acquisition process such as variations in illumination and presence of noise, because they totally rely on the image intensity values to encode the image information. To overcome these problems, a novel technique named Multi-Texture Local Ternary Pattern (MTLTP) is proposed in this paper. MTLTP combines the edges and corners based on the local ternary pattern strategy to extract the local texture features of the input image. Then returns a spatial histogram feature vector which is the descriptor for each image that we use to recognize a human being. Experimental results using a k-nearest neighbors classifier (k-NN) on two publicly available datasets justify our algorithm for efficient face recognition in the presence of extreme variations of illumination/lighting environments and slight variation of pose conditions.

  4. Thermoelectric materials: ternary penta telluride and selenide compounds

    Science.gov (United States)

    Sharp, Jeffrey W.

    2002-06-04

    Ternary tellurium compounds and ternary selenium compounds may be used in fabricating thermoelectric devices with a thermoelectric figure of merit (ZT) of 1.5 or greater. Examples of such compounds include Tl.sub.2 SnTe.sub.5, Tl.sub.2 GeTe.sub.5, K.sub.2 SnTe.sub.5 and Rb.sub.2 SnTe.sub.5. These compounds have similar types of crystal lattice structures which include a first substructure with a (Sn, Ge) Te.sub.5 composition and a second substructure with chains of selected cation atoms. The second substructure includes selected cation atoms which interact with selected anion atoms to maintain a desired separation between the chains of the first substructure. The cation atoms which maintain the desired separation between the chains occupy relatively large electropositive sites in the resulting crystal lattice structure which results in a relatively low value for the lattice component of thermal conductivity (.kappa..sub.g). The first substructure of anion chains indicates significant anisotropy in the thermoelectric characteristics of the resulting semiconductor materials.

  5. Thermoelectric materials ternary penta telluride and selenide compounds

    Science.gov (United States)

    Sharp, Jeffrey W.

    2001-01-01

    Ternary tellurium compounds and ternary selenium compounds may be used in fabricating thermoelectric devices with a thermoelectric figure of merit (ZT) of 1.5 or greater. Examples of such compounds include Tl.sub.2 SnTe.sub.5, Tl.sub.2 GeTe.sub.5, K.sub.2 SnTe.sub.5 and Rb.sub.2 SnTe.sub.5. These compounds have similar types of crystal lattice structures which include a first substructure with a (Sn, Ge) Te.sub.5 composition and a second substructure with chains of selected cation atoms. The second substructure includes selected cation atoms which interact with selected anion atoms to maintain a desired separation between the chains of the first substructure. The cation atoms which maintain the desired separation between the chains occupy relatively large electropositive sites in the resulting crystal lattice structure which results in a relatively low value for the lattice component of thermal conductivity (.kappa..sub.g). The first substructure of anion chains indicates significant anisotropy in the thermoelectric characteristics of the resulting semiconductor materials.

  6. Effects of Hydrogen on Acceptor Activation in Ternary Nitride Semiconductors

    Energy Technology Data Exchange (ETDEWEB)

    Fioretti, Angela N. [National Renewable Energy Laboratory, Golden CO 80401 USA; Colorado School of Mines, Golden CO 80401 USA; Stokes, Adam [National Renewable Energy Laboratory, Golden CO 80401 USA; Colorado School of Mines, Golden CO 80401 USA; Young, Matthew R. [National Renewable Energy Laboratory, Golden CO 80401 USA; Gorman, Brian [Colorado School of Mines, Golden CO 80401 USA; Toberer, Eric S. [National Renewable Energy Laboratory, Golden CO 80401 USA; Colorado School of Mines, Golden CO 80401 USA; Tamboli, Adele C. [National Renewable Energy Laboratory, Golden CO 80401 USA; Colorado School of Mines, Golden CO 80401 USA; Zakutayev, Andriy [National Renewable Energy Laboratory, Golden CO 80401 USA

    2017-02-09

    Doping control is necessary to unlock the scientific and technological potential of many materials, including ternary II-IV-nitride semiconductors, which are closely related to binary GaN. In particular, ZnSnN2 has been reported to have degenerate doping density, despite bandgap energies that are well suited for solar energy conversion. Here, we show that annealing Zn-rich Zn1+xSn1-xN2 grown with added hydrogen reduces its free electron density by orders of magnitude, down to 4 x 1016 cm-3. This experimental observation can be explained by hydrogen passivation of acceptors in Zn1+xSn1-xN2 during growth, lowering the driving force for unintentional donor formation. These results indicate that the doping control principles used in GaN can be translated to ZnSnN2, suggesting that other strategies used in binary III-Vs can be applied to accelerate the technological development of ternary II-IV-N2 materials.

  7. A study of phase separation in ternary alloys

    Indian Academy of Sciences (India)

    Saswata Bhattacharyya; T A Abinandanan

    2003-01-01

    We have studied the evolution of microstructure when a disordered ternary alloy is quenched into a ternary miscibility gap. We have used computer simulations based on multicomponent Cahn–Hilliard (CH) equations for A and B, the compositions (in mole fraction) of A and B, respectively. In this work, we present our results on the effect of relative interfacial energies on the temporal evolution of morphologies during spinodal phase separation of an alloy with average composition, A = 1/4, B = 1/4 and A = 1/2. Interfacial energies between the ‘A’ rich, ‘B’ rich and ‘C’ rich phases are varied by changing the gradient energy coefficients. The phases associated with a higher interfacial energy are found to be more rounded than those with lower energy. Further, the kinetic paths (i.e. the history of A-rich, B-rich and C-rich regions in the microstructure) are also affected significantly by the relative interfacial energies of the three phases.

  8. Formulation and evaluation of fast dissolving tablet containing domperidone ternary solid dispersion.

    Science.gov (United States)

    Patel, Dasharath M; Patel, Sweeti P; Patel, Chhagan N

    2014-10-01

    Fast dissolving tablet containing domperidone ternary solid dispersion was developed to improve the dissolution of drug and stability of solid dispersion. Binary and ternary solid dispersions were prepared by fusion method. They were characterized by solubility study, in vitro dissolution, dissolution efficiency, and stability study. The solid state properties of solid dispersions were characterized by differential scanning calorimetry (DSC), Fourier transform infrared spectroscopy (FTIR), and X-ray diffraction (XRD). Ternary solid dispersion was successfully incorporated into fast dissolving tablet by direct compression method. Tablets were characterized for pre-compression parameters, post-compression parameters, and stability study. Optimized ternary solid dispersion containing ratio 1:2:1.5 of drug: Gelucire 50/13: Poloxamer 188 gave maximum dissolution. The FTIR, DSC, and XRD studies of solid dispersions were confirmed the formation of solid dispersion. Ternary solid dispersion was more stable compared to binary solid dispersion at accelerated environment conditions for one month as confirmed by DSC study. Crospovidone as a superdisintegrant (4%) showed good result with disintegration time of 19 s and dissolution near to 100% in 0.1N HCL at 30 min. The studies indicated that the dissolution of drug and stability of solid dispersion was improved in the presence of ternary agent (surfactant) as compared to binary solid dispersion. It was concluded that fast dissolving tablet containing ternary solid dispersion was stable at accelerated environmental conditions for 1 month.

  9. Multi-modal fission in collinear ternary cluster decay of 252Cf(sf, fff

    Directory of Open Access Journals (Sweden)

    W. von Oertzen

    2015-06-01

    Full Text Available We discuss the multiple decay modes of collinear fission in 252Cf(sf, fff, with three fragments as suggested by the potential energy surface (PES. Fission as a statistical decay is governed by the phase space of the different decay channels, which are suggested in the PES-landscape. The population of the fission modes is determined by the minima in the PES at the scission points and on the internal potential barriers. The ternary collinear decay proceeds as a sequential process, in two steps. The originally observed ternary decay of 252Cf(sf into three different masses (e.g. 132–140Sn, 52–48Ca, 68–72Ni, observed by the FOBOS group in the FLNR (Flerov Laboratory for Nuclear Reactions of the JINR (Dubna the collinear cluster tripartition (CCT, is one of the ternary fission modes. This kind of “true ternary fission” of heavy nuclei has often been predicted in theoretical works during the last decades. In the present note we discuss different ternary fission modes in the same system. The PES shows pronounced minima, which correspond to several modes of ternary fragmentations. These decays have very similar dynamical features as the previously observed CCT-decays. The data obtained in the experiments on CCT allow us to extract the yields for different decay modes using specific gates on the measured parameters, and to establish multiple modes of the ternary fission decay.

  10. Quantum dot ternary-valued full-adder: Logic synthesis by a multiobjective design optimization based on a genetic algorithm

    Energy Technology Data Exchange (ETDEWEB)

    Klymenko, M. V.; Remacle, F., E-mail: fremacle@ulg.ac.be [Department of Chemistry, B6c, University of Liege, B4000 Liege (Belgium)

    2014-10-28

    A methodology is proposed for designing a low-energy consuming ternary-valued full adder based on a quantum dot (QD) electrostatically coupled with a single electron transistor operating as a charge sensor. The methodology is based on design optimization: the values of the physical parameters of the system required for implementing the logic operations are optimized using a multiobjective genetic algorithm. The searching space is determined by elements of the capacitance matrix describing the electrostatic couplings in the entire device. The objective functions are defined as the maximal absolute error over actual device logic outputs relative to the ideal truth tables for the sum and the carry-out in base 3. The logic units are implemented on the same device: a single dual-gate quantum dot and a charge sensor. Their physical parameters are optimized to compute either the sum or the carry out outputs and are compatible with current experimental capabilities. The outputs are encoded in the value of the electric current passing through the charge sensor, while the logic inputs are supplied by the voltage levels on the two gate electrodes attached to the QD. The complex logic ternary operations are directly implemented on an extremely simple device, characterized by small sizes and low-energy consumption compared to devices based on switching single-electron transistors. The design methodology is general and provides a rational approach for realizing non-switching logic operations on QD devices.

  11. Quantum dot ternary-valued full-adder: Logic synthesis by a multiobjective design optimization based on a genetic algorithm

    Science.gov (United States)

    Klymenko, M. V.; Remacle, F.

    2014-10-01

    A methodology is proposed for designing a low-energy consuming ternary-valued full adder based on a quantum dot (QD) electrostatically coupled with a single electron transistor operating as a charge sensor. The methodology is based on design optimization: the values of the physical parameters of the system required for implementing the logic operations are optimized using a multiobjective genetic algorithm. The searching space is determined by elements of the capacitance matrix describing the electrostatic couplings in the entire device. The objective functions are defined as the maximal absolute error over actual device logic outputs relative to the ideal truth tables for the sum and the carry-out in base 3. The logic units are implemented on the same device: a single dual-gate quantum dot and a charge sensor. Their physical parameters are optimized to compute either the sum or the carry out outputs and are compatible with current experimental capabilities. The outputs are encoded in the value of the electric current passing through the charge sensor, while the logic inputs are supplied by the voltage levels on the two gate electrodes attached to the QD. The complex logic ternary operations are directly implemented on an extremely simple device, characterized by small sizes and low-energy consumption compared to devices based on switching single-electron transistors. The design methodology is general and provides a rational approach for realizing non-switching logic operations on QD devices.

  12. Designing and analysing parallel control for multifeed ternary systems

    Directory of Open Access Journals (Sweden)

    Rocío Solar-González

    2010-06-01

    Full Text Available This paper explores a parallel control structure for improving the behaviour of a chemical plant having recycling and multi- ple feed streams; a ternary system is taken as an example,having an A + B → C second-order irreversible reaction. Material recycling dynamics can induce the so-called snowball effect in the presence of disturbance in the feed stream. The snowball effect can be prevented by distributing load through the parallel control scheme. A control structure was thus pro- posed where product composition was regulated by means of simultaneous feedback manipulation of final column vapour boilup rate and reactor temperature. An extension was made for one reactor, one distillation column and recycle stream configuration. Nonlinear simulations showed that effective composition control could be obtained with moderate vapour boilup control efforts.

  13. Morphological Control Agent in Ternary Blend Bulk Heterojunction Solar Cells

    Directory of Open Access Journals (Sweden)

    Hsueh-Chung Liao

    2014-11-01

    Full Text Available Bulk heterojunction (BHJ organic photovoltaic (OPV promise low cost solar energy and have caused an explosive increase in investigations during the last decade. Control over the 3D morphology of BHJ blend films in various length scales is one of the pillars accounting for the significant advance of OPV performance recently. In this contribution, we focus on the strategy of incorporating an additive into BHJ blend films as a morphological control agent, i.e., ternary blend system. This strategy has shown to be effective in tailoring the morphology of BHJ through different inter- and intra-molecular interactions. We systematically review the morphological observations and associated mechanisms with respect to various kinds of additives, i.e., polymers, small molecules and inorganic nanoparticles. We organize the effects of morphological control (compatibilization, stabilization, etc. and provide general guidelines for rational molecular design for additives toward high efficiency and high stability organic solar cells.

  14. Ternary semitransparent organic solar cells with a laminated top electrode

    Science.gov (United States)

    Makha, Mohammed; Testa, Paolo; Anantharaman, Surendra Babu; Heier, Jakob; Jenatsch, Sandra; Leclaire, Nicolas; Tisserant, Jean-Nicolas; Véron, Anna C.; Wang, Lei; Nüesch, Frank; Hany, Roland

    2017-01-01

    Abstract Tinted and colour-neutral semitransparent organic photovoltaic elements are of interest for building-integrated applications in windows, on glass roofs or on facades. We demonstrate a semitransparent organic photovoltaic cell with a dry-laminated top electrode that achieves a uniform average visible transmittance of 51% and a power conversion efficiency of 3%. The photo-active material is based on a majority blend composed of a visibly absorbing donor polymer and a fullerene acceptor, to which a selective near-infrared absorbing cyanine dye is added as a minority component. Our results show that organic ternary blends are attractive for the fabrication of semitransparent solar cells in general, because a guest component with a complementary absorption can compensate for the inevitably reduced current generation capability of a high-performing binary blend when applied as a thin, semitransparent film. PMID:28179960

  15. Ternary oxide nanostructures and methods of making same

    Science.gov (United States)

    Wong, Stanislaus S.; Park, Tae-Jin

    2009-09-08

    A single crystalline ternary nanostructure having the formula A.sub.xB.sub.yO.sub.z, wherein x ranges from 0.25 to 24, and y ranges from 1.5 to 40, and wherein A and B are independently selected from the group consisting of Ag, Al, As, Au, B, Ba, Br, Ca, Cd, Ce, Cl, Cm, Co, Cr, Cs, Cu, Dy, Er, Eu, F, Fe, Ga, Gd, Ge, Hf, Ho, I, In, Ir, K, La, Li, Lu, Mg, Mn, Mo, Na, Nb, Nd, Ni, Os, P, Pb, Pd, Pr, Pt, Rb, Re, Rh, Ru, S, Sb, Sc, Se, Si, Sm, Sn, Sr, Ta, Tb, Tc, Te, Ti, Tl, Tm, U, V, W, Y, Yb, and Zn, wherein the nanostructure is at least 95% free of defects and/or dislocations.

  16. Si-Ge-metal ternary phase diagram calculations

    Science.gov (United States)

    Fleurial, J. P.; Borshchevsky, A.

    1990-01-01

    Solution crystal growth and doping conditions of Si-Ge alloys used for high-temperature thermoelectric generation are determined here. Liquid-phase epitaxy (LPE) has been successfully employed recently to obtain single-crystalline homogeneous layers of Si-Ge solid solutions from a liquid metal solvent. Knowledge of Si-Ge-metallic solvent ternary phase diagrams is essential for further single-crystal growth development. Consequently, a thermodynamic equilibrium model was used to calculate the phase diagrams of the Si-Ge-M systems, including solid solubilities, where M is Al, Ga, In, Sn, Pb, Sb, or Bi. Good agreement between calculated liquidus and solidus data and experimental DTA and microprobe results was obtained. The results are used to compare the suitability of the different systems for crystal growth (by LPE-type process).

  17. Comprehensive characterization of chitosan/PEO/levan ternary blend films.

    Science.gov (United States)

    Bostan, Muge Sennaroglu; Mutlu, Esra Cansever; Kazak, Hande; Sinan Keskin, S; Oner, Ebru Toksoy; Eroglu, Mehmet S

    2014-02-15

    Ternary blend films of chitosan, PEO (300,000) and levan were prepared by solution casting method and their phase behavior, miscibility, thermal and mechanical properties as well as their surface energy and morphology were characterized by different techniques. FT-IR analyses of blend films indicated intermolecular hydrogen bonding between blend components. Thermal and XRD analysis showed that chitosan and levan suppressed the crystallinity of PEO up to nearly 25% of PEO content in the blend, which resulted in more amorphous film structures at higher PEO/(chitosan+levan) ratios. At more than 30% of PEO concentration, contact angle (CA) measurements showed a surface enrichment of PEO whereas at lower PEO concentrations, chitosan and levan were enriched on the surfaces leading to more amorphous and homogenous surfaces. This result was further confirmed by atomic force microscopy (AFM) images. Cell proliferation and viability assay established the high biocompatibility of the blend films.

  18. Hardness and Microstructure of Binary and Ternary Nitinol Compounds

    Science.gov (United States)

    Stanford, Malcolm K.

    2016-01-01

    The hardness and microstructure of twenty-six binary and ternary Nitinol (nickel titanium, nickel titanium hafnium, nickel titanium zirconium and nickel titanium tantalum) compounds were studied. A small (50g) ingot of each compound was produced by vacuum arc remelting. Each ingot was homogenized in vacuum for 48 hr followed by furnace cooling. Specimens from the ingots were then heat treated at 800, 900, 1000 or 1100 degree C for 2 hr followed by water quenching. The hardness and microstructure of each specimen was compared to the baseline material (55-Nitinol, 55 at.% nickel - 45 at.% titanium, after heat treatment at 900 degC). The results show that eleven of the studied compounds had higher hardness values than the baseline material. Moreover, twelve of the studied compounds had measured hardness values greater 600HV at heat treatments from 800 to 900 degree C.

  19. Ternary metal-rich sulfide with a layered structure

    Science.gov (United States)

    Franzen, Hugo F.; Yao, Xiaoqiang

    1993-08-17

    A ternary Nb-Ta-S compound is provided having the atomic formula, Nb.sub.1.72 Ta.sub.3.28 S.sub.2, and exhibiting a layered structure in the sequence S-M3-M2-M1-M2-M3-S wherein S represents sulfur layers and M1, M2, and M3 represent Nb/Ta mixed metal layers. This sequence generates seven sheets stacked along the [001] direction of an approximate body centered cubic crystal structure with relatively weak sulfur-to-sulfur van der Waals type interactions between adjacent sulfur sheets and metal-to-metal bonding within and between adjacent mixed metal sheets.

  20. Structural and Thermoelectric Properties of Ternary Full-Heusler Alloys

    Science.gov (United States)

    Hayashi, K.; Eguchi, M.; Miyazaki, Y.

    2016-09-01

    The thermoelectric properties of ternary full-Heusler alloys, Co2 YZ, which are in a ferromagnetic state up to high temperature above 300 K, were measured and are discussed in terms of the crystal structure and electronic states. Among the full-Heusler alloys studied, the Co2MnSi sample exhibited the highest absolute value of Seebeck coefficient and also the highest electrical conductivity in the temperature range from 300 K to 1023 K. The highest power factor of 2.9 × 10-3 W/m-K2 was obtained for the Co2MnSi sample at 550 K, demonstrating the potential of half-metallic full-Heusler alloys as thermoelectric materials.

  1. Ternary semitransparent organic solar cells with a laminated top electrode.

    Science.gov (United States)

    Makha, Mohammed; Testa, Paolo; Anantharaman, Surendra Babu; Heier, Jakob; Jenatsch, Sandra; Leclaire, Nicolas; Tisserant, Jean-Nicolas; Véron, Anna C; Wang, Lei; Nüesch, Frank; Hany, Roland

    2017-01-01

    Tinted and colour-neutral semitransparent organic photovoltaic elements are of interest for building-integrated applications in windows, on glass roofs or on facades. We demonstrate a semitransparent organic photovoltaic cell with a dry-laminated top electrode that achieves a uniform average visible transmittance of 51% and a power conversion efficiency of 3%. The photo-active material is based on a majority blend composed of a visibly absorbing donor polymer and a fullerene acceptor, to which a selective near-infrared absorbing cyanine dye is added as a minority component. Our results show that organic ternary blends are attractive for the fabrication of semitransparent solar cells in general, because a guest component with a complementary absorption can compensate for the inevitably reduced current generation capability of a high-performing binary blend when applied as a thin, semitransparent film.

  2. Boron-Based Hydrogen Storage: Ternary Borides and Beyond

    Energy Technology Data Exchange (ETDEWEB)

    Vajo, John J. [HRL Laboratories, LLC, Malibu, CA (United States)

    2016-04-28

    DOE continues to seek reversible solid-state hydrogen materials with hydrogen densities of ≥11 wt% and ≥80 g/L that can deliver hydrogen and be recharged at moderate temperatures (≤100 °C) and pressures (≤100 bar) enabling incorporation into hydrogen storage systems suitable for transportation applications. Boron-based hydrogen storage materials have the potential to meet the density requirements given boron’s low atomic weight, high chemical valance, and versatile chemistry. However, the rates of hydrogen exchange in boron-based compounds are thus far much too slow for practical applications. Although contributing to the high hydrogen densities, the high valance of boron also leads to slow rates of hydrogen exchange due to extensive boron-boron atom rearrangements during hydrogen cycling. This rearrangement often leads to multiple solid phases occurring over hydrogen release and recharge cycles. These phases must nucleate and react with each other across solid-solid phase boundaries leading to energy barriers that slow the rates of hydrogen exchange. This project sought to overcome the slow rates of hydrogen exchange in boron-based hydrogen storage materials by minimizing the number of solid phases and the boron atom rearrangement over a hydrogen release and recharge cycle. Two novel approaches were explored: 1) developing matched pairs of ternary borides and mixed-metal borohydrides that could exchange hydrogen with only one hydrogenated phase (the mixed-metal borohydride) and only one dehydrogenated phase (the ternary boride); and 2) developing boranes that could release hydrogen by being lithiated using lithium hydride with no boron-boron atom rearrangement.

  3. Ternary-fission mass distribution of 252Cf: A level-density approach

    Science.gov (United States)

    Balasubramaniam, M.; Karthikraj, C.; Selvaraj, S.; Arunachalam, N.

    2014-11-01

    We study here the ternary-fission mass distribution of the 252Cf nucleus for a fixed third fragment 48Ca using the level-density approach within the framework of statistical theory. For the evaluation of nuclear level densities, the single-particle energies of the finite-range droplet model are used. Our results for temperatures T =1 and 2 MeV reproduce qualitatively the experimental expectation of ternary fragmentation of 132Sn +72Ni +48Ca . In addition, different possible ternary-fission modes are highlighted.

  4. Role of electron concentration in softening and hardening of ternary molybdenum alloys

    Science.gov (United States)

    Stephens, J. R.; Witzke, W. R.

    1975-01-01

    Effects of various combinations of hafnium, tantalum, rhenium, osmium, iridium, and platinum in ternary molybdenum alloys on alloy softening and hardening were determined. Hardness tests were conducted at four test temperatures over the temperature range 77 to 411 K. Results showed that hardness data for ternary molybdenum alloys could be correlated with anticipated results from binary data based upon expressions involving the number of s and d electrons contributed by the solute elements. The correlation indicated that electron concentration plays a dominant role in controlling the hardness of ternary molybdenum alloys.

  5. Influence of alloy ingredients on mechanical properties of ternary boride hard alloy clad materials

    Institute of Scientific and Technical Information of China (English)

    LIU Fu-tian; SONG Shi-xue; YANG Jun-ru; HUANG Wei-ling; HUANG Chuan-zhen; CHENG Xin; LI Zhao-qian

    2004-01-01

    Using Mo, B-Fe alloy and Fe powders as raw materials, and adding C, Cr and Ni ingredients, respectively, or C, Cr and Ni mixed powders, ternary boride hard alloy clad materials was prepared on Q235 steel substrate by means of in-situ reaction and vacuum liquid phase sintering technology. The influence of alloy ingredients on the mechanical properties of ternary boride hard alloy clad materials was investigated. The results indicate that a mixture of 0.8% C, 5% Cr and 2% Ni ingredients gives a ternary boride hard alloy clad material with optimal mechanical properties, such as high transverse rupture strength, high hardness and good wear resistance.

  6. Ternary Free Energy Lattice Boltzmann Model with Tunable Surface Tensions and Contact Angles

    CERN Document Server

    Semprebon, Ciro; Kusumaatmaja, Halim

    2015-01-01

    We present a new ternary free energy lattice Boltzmann model. The distinguishing feature of our model is that we are able to analytically derive and independently vary all fluid-fluid surface tensions and the solid surface contact angles. We carry out a number of benchmark tests: (i) double emulsions and liquid lenses to validate the surface tensions, (ii) ternary fluids in contact with a square well to compare the contact angles against analytical predictions, and (iii) ternary phase separation to verify that the multicomponent fluid dynamics is accurately captured. Additionally we also describe how the model here presented here can be extended to include an arbitrary number of fluid components.

  7. Interaction between ropinirole hydrochloride and aspirin with human serum albumin as binary and ternary systems by multi-spectroscopic, molecular modeling and zeta potential

    Energy Technology Data Exchange (ETDEWEB)

    Mahaki, Hanie, E-mail: hanieh.mahaki@gmail.com [Department of Biology, Faculty of Sciences, Mashhad Branch, Islamic Azad University, Mashhad (Iran, Islamic Republic of); Memarpoor-Yazdi, Mina; Chamani, Jamshidkhan [Department of Biology, Faculty of Sciences, Mashhad Branch, Islamic Azad University, Mashhad (Iran, Islamic Republic of); Reza Saberi, Mohammad [Medical Chemistry Department, School of Pharmacy, Mashhad University of Medical Sciences, Mashhad (Iran, Islamic Republic of)

    2013-02-15

    The aim of the present study was to describe the competition of ropinirole hydrochloride (RP) and aspirin (ASA) in binding to human serum albumin (HSA) in physiological buffer (pH=7.4) using multi-spectroscopic, molecular modeling and zeta-potential measurements. Fluorescence analysis was used to define the binding and quenching properties of drug-HSA complexes in binary and ternary systems. Fluorescence spectroscopy showed that in the presence of RP, the binding constant of HSA-ASA was increased. Static quenching was confirmed to result in the fluorescence quenching and FRET. The effect of drugs on the conformation of HSA was analyzed using synchronous fluorescence spectroscopy, three-dimensional fluorescence spectra and circular dichroism (CD). The RLS method determined the critical aggregation concentration of drugs on HSA in binary and ternary systems that confirmed the zeta potential results. Structural modeling showed that the affinity of each of the drugs to HSA in binary and ternary systems confirms the spectroscopic results. - Highlights: Black-Right-Pointing-Pointer We studied the interaction of ropinirole hydrochloride and aspirin with HSA. Black-Right-Pointing-Pointer Molecular modeling and zeta-potential used to describe competitive interaction. Black-Right-Pointing-Pointer We determined the critical induced aggregation concentration of both drugs on HSA. Black-Right-Pointing-Pointer The binding mechanism of drugs as separate and simultaneous to HSA has been compared. Black-Right-Pointing-Pointer The binding site of both drugs as simultaneous effects on HSA has been determined.

  8. Syntheses and luminescence properties of ternary europium complexes with succinic acid derivative and 2,2'-bipyridine%铕-丁二酸衍生物-2,2'-联吡啶三元配合物的合成和荧光性质研究

    Institute of Scientific and Technical Information of China (English)

    刘胜利; 欧阳涛; 禹良才; 朱金良

    2011-01-01

    Six temary Eu ( Ⅲ ) complexes were synthesized by using succinic acid ( L1 ) , methyl - succinic acid ( L2 ) , methylene - succinic acid ( L3 ) , mercapto - succinic acid ( L4 ) , bromo - succinic acid ( L5) , hydroxy - succinic acid ( L6) as the first ligand and 2,2' - bipyridine ( bipy) as the second ligand. The compositions of complexes were Eu2 ( L) 3bipy · 2H2O (L = succinic acid and its derivatives) which were characterized by TG -DTG and rare earth compleximetry. Their properties were characterized by means of IR spectra and fluorescence spectra at room temperature. Fluorescence spectroscopy showed that the changes of substituents had small influence on the positions of complexes ' excitation peaks and emission peaks. but large on the fluorescence intensity, and the fluorescence intensity of complexes decreased in the order of substituents: - SH, - Br, - H, - OH, - CH3 , -CH2.%分别以丁二酸(L1)、2-甲基丁二酸(L2)、2-亚甲基丁二酸(L3)、2-巯基丁二酸(L4)、2-澳基丁二酸(L5)、2-羟基丁二酸(L6)为第一配体,2,2-联吡啶(bipy)为第二配体,合成了6种稀土铕的三元配合物,通过差热分析及稀土络合滴定确定了配合物的组成为Eu2(L)3bipy·2H2O(L=丁二酸及其衍生物).通过红外光谱、荧光光谱表征了配合物的性质.对6种配合物进行荧光光谱研究,结果表明:配体取代基的变化对配合物荧光激发蜂和发射蜂的位置变化影响很小,但对配合物的荧光强度有较大影响,其配合物的荧光强度大小为:-SH>-Br>-H>-OH>-CH3>-CH2.

  9. Synthesis, Characterization and Crystal Structure of Ternary Cu (Ⅱ) Complex with 1, 10-Phenanthroline and L-Methioninate%1,10-邻菲咯啉-铜(Ⅱ)-L-蛋氨酸配合物的合成、表征及其分子结构

    Institute of Scientific and Technical Information of China (English)

    乐学义; 童明良

    2002-01-01

    The complex [Cu(L-met) (phen) (H20)] NO3 @ H20 has been synthesized and investigated by elementalanalysis, molar conductivity, spectroscopic and X-ray diffraction methods, where phen = 1, 10-phenanthroline andL-met = L-methioninate group. The complex crystallized in the monoclinic space group P21 with a = 12. 053 (2)A,b=6.886(1) A, c=13.385(3) A, β=113. 59(3)., V=1018.1(3) A3, Z=2, Dc=1.598g@ em-3, μ=1. 223mm-1, F(000) =506, R1 =0. 0306, and wR2=0. 0742. The copper (II) atom is ligated in a distortedsquare-pyramidal geometry by two nitrogen atoms of one phen and the amino nitrogen atom, one carboxylate oxygenatom of L-met in the base plane, and an aqua at the apical position. A one-dimensional chain configuration formedby the hydrogen-bonding and weak Cu-O (the uncoordinated carboxyl oxygen atom) coordination interactions be-tween neighboring [Cu(L-met) (phen) (H20) ] + cations. CCDC: 183368.

  10. Experimental study and thermodynamic description of the erbium–hydrogen–zirconium ternary system

    Energy Technology Data Exchange (ETDEWEB)

    Mascaro, Aurore [CEA-Saclay, Nuclear Energy Division, Nuclear Materials Department, SRMA, LA2M, 91191 Gif-Sur-Yvette (France); Chimie Métallurgique des Terres Rares, Institut de Chimie et des Matériaux Paris-Est, CNRS, Université Paris-Est Créteil, 2-8 rue H. Dunant, 94320 Thiais (France); Toffolon-Masclet, Caroline [CEA-Saclay, Nuclear Energy Division, Nuclear Materials Department, SRMA, LA2M, 91191 Gif-Sur-Yvette (France); Raepsaet, Caroline [CEA-Saclay, DSM/IRAMIS/NIMBE/LEEL, 91191 Gif-Sur-Yvette (France); Crivello, Jean-Claude [Chimie Métallurgique des Terres Rares, Institut de Chimie et des Matériaux Paris-Est, CNRS, Université Paris-Est Créteil, 2-8 rue H. Dunant, 94320 Thiais (France); Joubert, Jean-Marc, E-mail: jean-marc.joubert@icmpe.cnrs.fr [Chimie Métallurgique des Terres Rares, Institut de Chimie et des Matériaux Paris-Est, CNRS, Université Paris-Est Créteil, 2-8 rue H. Dunant, 94320 Thiais (France)

    2015-01-15

    The erbium–hydrogen–zirconium (Er–H–Zr) ternary system has been investigated experimentally at 350 °C using high purity materials. The extent of the ternary homogeneity domains have been measured using two combined experimental techniques: X-ray diffraction and ion beam analysis. An isothermal section is proposed according to these measurements. The three binary systems Er–H, Er–Zr and H–Zr were already assessed using the Calphad method. After making them compatible with each other and assigning the enthalpy of formation of the new generated end-members (including in H–Zr system) to the results of DFT calculations, the ternary system has been calculated without using any ternary parameter. The calculated isothermal section at 350 °C shows a fair agreement with the experimental data and the behavior at higher temperature is predicted.

  11. Effect of repeated presentation on sweetness intensity of binary and ternary mixtures of sweeteners

    National Research Council Canada - National Science Library

    Schiffman, Susan S; Sattely-Miller, Elizabeth A; Graham, Brevick G; Zervakis, Jennifer; Butchko, Harriett H; Stargel, W Wayne

    2003-01-01

    .... The individual components in the binary sweetener combinations were intensity-anchored with 5% sucrose, while the individual sweeteners in the ternary mixtures were intensity-anchored with 3% sucrose...

  12. Mechanism of Ternary Fission in System 197Au+197Au at 15 AMeV

    Institute of Scientific and Technical Information of China (English)

    2008-01-01

    <正>For very heavy nuclear systems there is very clear evidence for fission into three comparable mass fragments. The responsible mechanisms for this type of fission are the direct ternary fission and

  13. Ternary and Multi-Bit FIR Filter Area-Performance Tradeoffs in FPGA

    Directory of Open Access Journals (Sweden)

    Khalil-Ur-Rahman Dayo

    2013-01-01

    Full Text Available In this paper, performance and area of conventional FIR (Finite Impulse Responce filters versus ternary sigma delta modulated FIR filter is compared in FPGA (Field Programmable Gate Arrays using VHDL (Verilog Description Language. Two different approaches were designed and synthesized at same spectral performance by obtaining a TIR (Target Impulse Response. Both filters were synthesized on adaptive LUT (Look Up Table FPGA device in pipelined and non-pipelined modes. It is shown that the Ternary FIR filter occupies approximately the same area as the corresponding multi-bit filter, but for a given specification, the ternary FIR filter has 32% better performance in non-pipelined and 72% in pipelined mode, compared to its equivalent Multi-Bit filter at its optimum 12-bit coefficient quantization. These promising results shows that ternary logic based (i.e. +1,0,-1 filters can be used for huge chip area savings and higher performance.

  14. Enhanced KR-Fundamental Measure Functional for Inhomogeneous Binary and Ternary Hard Sphere Mixtures

    National Research Council Canada - National Science Library

    Zhou, Shi-Qi (世琦 周)

    2011-01-01

    An enhanced KR-fundamental measure functional (FMF) is elaborated and employed to investigate binary and ternary hard sphere fluids near a planar hard wall or confined within two planar hard walls separated by certain interval...

  15. Modeling and Implementation of Reliable Ternary Arithmetic and Logic Unit Design Using Vhdl

    Directory of Open Access Journals (Sweden)

    Meruva Kumar Raja

    2014-06-01

    Full Text Available Multivalve logic is a reliable method for defining, analyzing, testing and implementing the basic combinational circuitry with VHDL simulator. It offers better utilization of transmission channels because of its high speed for higher information carried out and it gives more efficient performance. One of the main realizing of the MVL (ternary logic is that reduces the number of required computation steps, simplicity and energy efficiency in digital logic design. This paper using reliable method is brought out for implementing the basic combinational, sequential and TALU (Ternary Arithmetic and Logic Unit circuitry with minimum number of ternary switching circuits (Multiplexers. In this the potential of VHDL modelling and simulation that can be applied to ternary switching circuits to verify its functionality and timing specifications. An intention is to show how proposed simulator can be used to simulate MVL circuits and to evaluate system performance.

  16. Study on the ternary ion-association complex nanoparticles of palladium(Ⅱ)-famotidine and halogen-fiuorescein dyes by the resonance Rayleigh scattering and their application%钯(Ⅱ)与法莫替丁和卤代荧光素染料三元离子缔合物纳米微粒的共振瑞利散射光谱及其分析应用

    Institute of Scientific and Technical Information of China (English)

    陈佩丽; 刘绍璞; 刘忠芳; 胡小莉

    2011-01-01

    In pH 3.5-4.7 NaAc-HAc buffer medium, famotidine (FMTD) reacted with palladium(Ⅱ) (Pd(Ⅱ)) to form chelate cation, which further reacted with halogen-fluorescein dyes (HF) such as dichlorofluorescein (DCF), dibromofluorescein (DBF), diiodofluorescein (DIF), Erythrosine (ER), eosine (EY) and eosin (EE) to form ternary ion-association complexes [Pd(FMTD)]·(HF)2. It further aggregated to form average diameter of about 9 nm nanoparticles by hydrophobic forces and Van der Waals forces. As a result, the absorption bands of DCF, DBF, DIF, ER, EY, EE were shifted, the fluorescences of them were quenched and the resonance Rayleigh scattering (RRS) were enhanced greatly. The maximum absorption wavelengths of [Pd(FMTD)·(HF)2] were located at 476 nm (DCF system), 540 nm (DBF system), 553 nm (DIF system), 560 nm (ER system), 547 nm (EY system), 549 nm (EE system) and the maximum RRS wavelengths of those were located at 302-361 nm. The A/ was proportional to the FMTD concentration in a certain range and the detection limit was 1.0-2.6 ng/L. Based on it, a high sensitive, good selective, rapid and new molecular spectrum method had been proposed to determine FMTD. It could be applied to determine FMTD in pharmaceutical preparation such as tablets, gelatin capsule and injection. In this work, the optimum reaction conditions, the influences of coexisting substances and the properties of analytical chemistry were investigated. Moreover, the mechanism of ion-association reaction and the reasons of enhancement for RRS were also discussed by the change of absorption, fluorescence and the formation of nanoparticles.%在pH 3.5~4.7 NaAc-HAc的缓冲溶液中,法莫替丁(FMTD)与Pd(Ⅱ)形成五元环螯合阳离子([Pd(FMTD)]2+),再与二氯荧光素(DCF)、二溴荧光素(DBF)、二碘荧光素(DIF)、赤鲜红(ER)、曙红Y(EY)、乙基曙红(EE)等卤代荧光素(HF)反应形成1∶1∶2的三元离子缔合物([Pd(FMTD)]·(HF)2).[Pd(FMTD)]·(HF)2在疏水作用和范德华力

  17. Synthesis and magnetic property of T4 virus-supported gold-coated iron ternary nanocomposite

    Energy Technology Data Exchange (ETDEWEB)

    Xu Ziming; Sun Hongjing; Gao Faming, E-mail: fmgao@ysu.edu.cn; Hou Li; Li Na [Yanshan University, Key Laboratory of Applied Chemistry (China)

    2012-12-15

    Herein, we present a novel method based on the use of the symmetrical T4 bacteriophage capsid as a scaffold for preparing the gold-coated iron ternary core/shell nanostructure. Results showed that the thick gold shell was obtained to effectively protect Fe core from oxidation. Magnetic measurements showed that the nanocomposites were superparamagnetic at room temperature with a blocking temperature of about 35 K. At 3 K, its coercivity of 1142.86 Oe was larger than the existing experimental values. The magnetic property of Au/T4 was also tested, demonstrating the source of the magnetic sample arising from the Fe core only. The absorption spectrum of the Fe-Au/T4 complex was measured and compared with gold/virus. Different thickness gold shells were controlled in the synthesis by tuning the Au salt addition. On the basis of results and discussion, we further speculated the general growing mechanism of the template-supported Fe-Au process.

  18. Initial Kinetic Studies of Iron Oxide and Humic Acid Ternary Systems

    Energy Technology Data Exchange (ETDEWEB)

    Farrelly, D.H.; Abrahamsen, G.; Pitois, A.; Ivanov, P.; Siu, B; Li, N.; Warw ick, P. [Centre for Radiochemistry Research, School of Chemistry, Univ. of Manch ester, Oxford Road, Manchester (United Kingdom)]. e-mail: Nick.Bryan@manchester.ac.uk; Evans , N.D.M. [Dept. of Chemistry, Univ. of Loughborough, Loughborough (United Kingdom); Knight, L. [U.K. Nirex, Harwell, Oxfordshire (United Kingdom)

    2007-06-15

    The interactions of Eu{sup 3+} ions, humic acid and iron oxides in ternary system experiments have been studied. The variations in the amount of humic acid and Eu{sup 3+} with time have been determined as a function of humic acid concentration. Two simple mathematical models have been developed to predict the behaviour of metal ions and humics in the experiments. The treatment of the binary interaction between humic acid and metal ion is common to both models: initial rapid uptake to an exchangeable fraction, followed by slower transfer to the non-exchangeable fraction. Both models assume that the interaction of the humic with the mineral surface is unaffected by the complexation of metal ions. The difference between the models is that the first (Model 1) assumes that the observed heterogeneity derives from multiple binding sites on the surface of the iron oxide, whilst the second assumes that it is the result of chemical or size heterogeneity of the humic itself. The behaviour of the magnetite system is best described by Model 1, but hematite follows Model 2 most closely, whilst goethite shows intermediate behaviour.

  19. Corrosion and anodic behaviour of zinc and its ternary alloys in alkaline battery electrolytes

    Science.gov (United States)

    Suresh Kannan, A. R.; Muralidharan, S.; Sarangapani, K. B.; Balaramachandran, V.; Kapali, V.

    Several attempts are being made to avoid the use of mercury-bearing zinc/zinc alloys as anodes in alkaline power sources. The work presented here suggests the possible use of some ternary alloys based on zinc of purity 99.9 to 99.95 wt.% as anodes in 10 M NaOH solution with sodium citrate, sodium stannate and calcium oxide as complexing agents and inhibitors. The corrosion of zinc and its alloys in 10 M NaOH solution is under cathodic control; in other alkaline electrolytes, it is under anodic control. Anode efficiency of up to 99.0% is achieved. The corrosion rates of zinc and its alloys are found to be comparable with those of mercury-bearing zinc in the chosen electrolytes. It is concluded that both dry cells and Zn-air batteries can be constructed with the above anodes and alkaline electrolytes. Thus, the presence of mercury, either in the anode or in the electrolyte, is avoided.

  20. Prediction of Activities in Fe-Based Ternary Liquid Alloys by Hoch-Arpshofen Model

    Institute of Scientific and Technical Information of China (English)

    YANGHong—wei; LIANChao; TAODong—ping

    2012-01-01

    Thermodynamic properties for an alloy system play an important role in the materials science and engineer- ing. Therefore, theoretical calculations having the flexibility to deal with complexity are very useful and have scien- tific meaning. The Hoch-Arpshofen model was deduced from physical principles and is applicable to binary, ternary and larger system using its binary interaction parameters only. Calculations of the activities of Fe-based liquid alloys are calculated using Hoch-Arpshofen model from data on the binary subsystems. Results for the activities for Fe-Au- Ni, Fe-Cr-Ni, Fe-Co-Cr and Fe-Co-Ni systems at required temperature are presented by Hoch-Arpshofen model. The average relative errors of prediction are 7.8%, 4.5%, 4.9~ and 2.7%, respectively. It shows that the calcu- lated results are in good agreement with the experimental data except Fe-Au-Ni system, which exhibits strong inter- action between unlike atoms. The model provides a simple, reliable and general method for calculating the activities for Fe-based liquid alloys.

  1. Composition Optimization of Lithium-Based Ternary Alloy Blankets for Fusion Reactors

    Science.gov (United States)

    Jolodosky, Alejandra

    any quantity of interest. This allows multiple responses to be calculated by perturbing the input parameter without having to directly perform separate calculations. The approach is strictly created for critical systems, but was utilized as the basis of a new methodology implemented for fixed source problems, known as Exact Perturbation Theory (EPT). EPT can calculate the tritium breeding ratio response, caused by a perturbation in the composition of the ternary alloy. The downfall of EPT methodology is that it cannot account for the collision history at large perturbations and thus, produces results with high uncertainties. Preliminary analysis for EPT with Serpent for a LiPbBa alloy demonstrated that 25 simulations per ternary must be completed so that most uncertainties calculated at large perturbations do not exceed 0.05. To reduce the uncertainties of the results, generalized least squares (GSL) method was implemented, to replace imprecise TBR results with more accurate ones. It was demonstrated that a combination of EPT Serpent calculations with the application of GLS for results with high uncertainties is the most effective and produces values with the highest fidelity. The scheme finds an alloy composition that has a TBR within a range of interest, while imposing constraint on the EMF, and a requirement to minimize lithium concentration. It involved a three-level iteration process with each level zooming in closer on the area of interest to fine tune the correct composition. Both alloys studied, LiPbBa and LiSnZn, had optimized compositions close to the leftmost edge of the ternary, increasing the complexity of optimization due to the highly uncertain results found in these regions. Additional GPT methodologies were considered for optimization studies, specifically with the use of deterministic codes. Currently, an optimization deterministic code, SMORES, is available in the SCALE code package, but only for critical systems. Subsequently, it was desired to

  2. Analytic calculation of formation enthalpies directly from interatomic potentials for binary and ternary refractory metal systems

    Institute of Scientific and Technical Information of China (English)

    2010-01-01

    An analytic method is proposed to calculate the formation enthalpy directly from empirical n-body potential and applied to the binary and ternary systems consisting of the refractory metals Mo, Nb, Ta and W. It turns out that the calculated enthalpies are in overall agreement with experimental observations and some other theoretical calculations. Interestingly, it shows that the formation enthalpies of the ternary systems are significantly affected by those of the constituent binary systems.

  3. Understanding of the dissipation mechanism in ternary fission for the system 197Au+197Au

    Science.gov (United States)

    Tian, Jun-Long; Li, Xian; Wu, Xi-Zhen; Li, Zhu-Xia; Yan, Shi-Wei

    2009-03-01

    The mass number distributions of three fragments from the ternary fission of the system 197Au+197Au are reproduced rather well by using the improved quantum molecular dynamics (ImQMD) model without any adjusting parameter. It is found that the probability of ternary fission evidently depends on the incident energy and the impact parameter, and the two-body dissipation is the main mechanism responsible for the formation of the third fragment with comparable mass.

  4. Experimental study of the phase diagram of the Ag-Au-Sb ternary system

    Energy Technology Data Exchange (ETDEWEB)

    Zoro, E. [Laboratoire de Chimie des Materiaux Inorganiques, Universite de Cocody, UFR-SSMT, 22 BP 582 Abidjan 22 (Ivory Coast) and Laboratoire de Physico-Chimie de l' Etat Solide, UMR 8648 Bat 410-415, 91405 Orsay Cedex (France); Laboratoire de Chimie Physique Minerale et Bioinorganique, EA401, Fac. Pharm., Universite de Paris-Sud XI, 5, rue JB Clement 92296 Chatenay Malabry (France); Servant, C. [Laboratoire de Physico-Chimie de l' Etat Solide, UMR 8648 Bat 410-415, 91405 Orsay Cedex (France)]. E-mail: colette.servant@lpces.u-psud.fr; Legendre, B. [Laboratoire de Chimie Physique Minerale et Bioinorganique, EA401, Fac. Pharm., Universite de Paris-Sud XI, 5, rue JB Clement 92296 Chatenay Malabry (France)

    2006-12-21

    The phase diagram of the Ag-Au-Sb ternary system has been assessed using X-ray diffraction analysis, electron-probe micro-analysis and differential scanning calorimetry. Four isopletic sections were studied: 80, 70 and 10 at.% Ag and 10 at.% Au. Three ternary invariant reactions were noted. This study is part of an international program, COST 531, about lead-free soldering materials.

  5. Surface tension isotherms of the dioxane-acetone-water and glycerol-ethanol-water ternary systems

    Science.gov (United States)

    Dzhambulatov, R. S.; Dadashev, R. Kh.; Elimkhanov, D. Z.; Dadashev, I. N.

    2016-10-01

    The results of the experimental and theoretical studies of the concentration dependence of surface tension of aqueous solutions of the 1,4-dioxane-acetone-water and glycerol-ethanol-water ternary systems were given. The studies were performed by the hanging-drop method on a DSA100 tensiometer. The maximum error of surface tension was 1%. The theoretical models for calculating the surface tension of the ternary systems of organic solutions were analyzed.

  6. Photovoltaic Devices Employing Ternary PbSxSe1-x Nanocrystals

    Energy Technology Data Exchange (ETDEWEB)

    Ma, Wanli; Luther, Joseph; Zheng, Haimei; Wu, Yue; Alivisatos, A. Paul

    2009-02-05

    We report solar cells based on highly confined nanocrystals of the ternary compound PbSxSe1-x. Crystalline, monodisperse alloyed nanocrystals are obtained using a one-pot, hot injection reaction. Rutherford back scattering and energy filtered transmission electron microscopy suggest that the S and Se anions are uniformly distributed in the alloy nanoparticles. Photovoltaic devices made using ternary nanoparticles are more efficient than either pure PbS or pure PbSe based nanocrystal devices.

  7. PREDICTION ON THE THERMODYNAMIC PROPERTIES OF TERNARY LIQUID ALLOYS BY MODIFIED COORDINATION EQUATION

    Institute of Scientific and Technical Information of China (English)

    D.P.Tao

    2001-01-01

    The coordination numbers in the Molecular Interaction Volume Model can be calcu-lated from the common physical quantities of pure matters.A significant advantage ofthe model lies in its ability to predict the thermodynamic properties of ternary liqmdalloys using only the binary infinite dilute activity coefficients,and the predicted values are in good agreement with the experimental data of ternary liquid alloys,whichshows that the model is reliable,convenient and economic.

  8. Ternary Organic Solar Cells Based on Two Compatible Nonfullerene Acceptors with Power Conversion Efficiency >10.

    Science.gov (United States)

    Liu, Tao; Guo, Yuan; Yi, Yuanping; Huo, Lijun; Xue, Xiaonan; Sun, Xiaobo; Fu, Huiting; Xiong, Wentao; Meng, Dong; Wang, Zhaohui; Liu, Feng; Russell, Thomas P; Sun, Yanming

    2016-12-01

    Two different nonfullerene acceptors and one copolymer are used to fabricate ternary organic solar cells (OSCs). The two acceptors show unique interactions that reduce crystallinity and form a homogeneous mixed phase in the blend film, leading to a high efficiency of ≈10.3%, the highest performance reported for nonfullerene ternary blends. This work provides a new approach to fabricate high-performance OSCs.

  9. Ternary fission of a heavy nuclear system within a three-center shell model

    Science.gov (United States)

    Karpov, A. V.

    2016-12-01

    Background: Since more than 40 years of theoretical and experimental studies of true ternary fission, one is still quite far from its understanding. The true ternary fission channel, being strongly suppressed by the macroscopic properties of the potential energy, may, however, be present with a significant probability due to shell effects. Purpose: Development of a model for the multidimensional potential energy suitable for analysis of the nucleus-nucleus collisions with the possibility of ternary exit channel. Study of the potential possibility of fission of actinides into three heavy fragments. Method: The asymmetric three-center shell model of deformed nucleus is developed in this paper. The model can be applied for analysis of ternary as well as binary fission processes. Results: The potential energy surfaces for few ternary combinations in the fission channel are calculated for the 252Cf nucleus. Their properties are discussed. Conclusions: The potential energy structures are compared with the experimental observations. It was found that the potential energy has pronounced valleys favorable for ternary fission with formation of doubly magic tin as one of the fragments and two other lighter fragments. The positions of the found fission valleys are in a good agreement with the experimental data.

  10. α-accompanied cold ternary fission of Pu-244238 isotopes in equatorial and collinear configuration

    Science.gov (United States)

    Santhosh, K. P.; Krishnan, Sreejith; Priyanka, B.

    2015-04-01

    The cold ternary fission of 238Pu, 240Pu, 242Pu, and 244Pu isotopes, with 4He as light charged particle, in equatorial and collinear configuration has been studied within the unified ternary fission model. The fragment combination 100Zr+4He+134Te possessing the near doubly magic nuclei 134Te(N =82 ,Z =52 ) gives the highest yield in the α-accompanied ternary fission of 238Pu. For the α-accompanied ternary fission of 240Pu, 242Pu, and 244Pu isotopes, the highest yield was found for the fragment combination with doubly magic nuclei 132Sn(N =82 ,Z =50 ) as the heavier fragment. The deformation and orientation of fragments have also been taken into account for the α-accompanied ternary fission of Pu-244238 isotopes, and it has been found that, in addition to the closed-shell effect, ground-state deformation also plays an important role in determining the isotopic yield in the ternary fission process. The emission probability and kinetic energy of long-range α particles have been calculated and are found to be in good agreement with the experimental data.

  11. Retention Mechanisms of Citric Acid in Ternary Kaolinite-Fe(III)-Citrate Acid Systems Using Fe K-edge EXAFS and L3,2-edge XANES Spectroscopy

    Science.gov (United States)

    Yang, Jianjun; Wang, Jian; Pan, Weinan; Regier, Tom; Hu, Yongfeng; Rumpel, Cornelia; Bolan, Nanthi; Sparks, Donald

    2016-05-01

    Organic carbon (OC) stability in tropical soils is strongly interlinked with multivalent cation interaction and mineral association. Low molecular weight organic acids (LMWOAs) represent the readily biodegradable OC. Therefore, investigating retention mechanisms of LMWOAs in mineral-cation-LMWOAs systems is critical to understanding soil C cycling. Given the general acidic conditions and dominance of kaolinite in tropical soils, we investigated the retention mechanisms of citric acid (CA) in kaolinite-Fe(III)-CA systems with various Fe/CA molar ratios at pH ~3.5 using Fe K-edge EXAFS and L3,2-edge XANES techniques. With Fe/CA molar ratios >2, the formed ferrihydrite mainly contributed to CA retention through adsorption and/or coprecipitation. With Fe/CA molar ratios from 2 to 0.5, ternary complexation of CA to kaolinite via a five-coordinated Fe(III) bridge retained higher CA than ferrihydrite-induced adsorption and/or coprecipitation. With Fe/CA molar ratios ≤0.5, kaolinite-Fe(III)-citrate complexation preferentially occurred, but less CA was retained than via outer-sphere kaolinite-CA complexation. This study highlighted the significant impact of varied Fe/CA molar ratios on CA retention mechanisms in kaolinite-Fe(III)-CA systems under acidic conditions, and clearly showed the important contribution of Fe-bridged ternary complexation on CA retention. These findings will enhance our understanding of the dynamics of CA and other LMWOAs in tropical soils.

  12. Two-band model interpretation of the p- to n-transition in ternary tetradymite topological insulators

    Energy Technology Data Exchange (ETDEWEB)

    Chasapis, T. C., E-mail: t-chasapis@northwestern.edu, E-mail: m-kanatzidis@northwestern.edu; Calta, N. P.; Kanatzidis, M. G., E-mail: t-chasapis@northwestern.edu, E-mail: m-kanatzidis@northwestern.edu [Department of Chemistry, Northwestern University, 2145 Sheridan Rd., Evanston, Illinois 60208 (United States); Koumoulis, D.; Leung, B. [Department of Chemistry and Biochemistry, University of California – Los Angeles, 607 Charles E. Young Drive East, Los Angeles, California 90095 (United States); Lo, S.-H.; Dravid, V. P. [Department of Materials Science and Engineering, Northwestern University, 2145 Sheridan Rd., Evanston, Illinois 60208 (United States); Bouchard, L.-S. [Department of Chemistry and Biochemistry, University of California – Los Angeles, 607 Charles E. Young Drive East, Los Angeles, California 90095 (United States); California NanoSystems Institute – UCLA, 570 Westwood Plaza, Los Angeles, California 90095 (United States)

    2015-08-01

    The requirement for large bulk resistivity in topological insulators has led to the design of complex ternary and quaternary phases with balanced donor and acceptor levels. A common feature of the optimized phases is that they lie close to the p- to n-transition. The tetradymite Bi{sub 2}Te{sub 3−x}Se{sub x} system exhibits minimum bulk conductance at the ordered composition Bi{sub 2}Te{sub 2}Se. By combining local and integral measurements of the density of states, we find that the point of minimum electrical conductivity at x = 1.0 where carriers change from hole-like to electron-like is characterized by conductivity of the mixed type. Our experimental findings, which are interpreted within the framework of a two-band model for the different carrier types, indicate that the mixed state originates from different types of native defects that strongly compensate at the crossover point.

  13. Combustion synthesis in the Ni-Al-Nb ternary system: A Time-Resolved X-ray Diffraction study

    Science.gov (United States)

    Sytschev, Alexander E.; Kovalev, Dmitry Yu.; Vrel, Dominique; Vadchenko, Sergey G.

    Combustion synthesis of intermetallics, using the thermal explosion mode, in the Ni-Al-Nb ternary system is presented, with a 40:40:20 atomic ratio. The kinetic pathway is determined using Time-Resolved X-ray Diffraction, with a time-step resolution of 1 s and demonstrated a first formation of the B2 NiAl structure followed by progressive dissolution of Nb to yield NiAlNb intermetallic Laves phase, representing 35 w% of the final product. SEM observations show a double dendritic (coarse and fine) microstructure, resulting from eutectic crystallization. Due to a high cooling rate, Nb dissolution is not complete at the surface, and yields slightly more complex microstructure, including the Ni2AlNb Geissler phase, the (Ni,Al)2Nb Laves phase, and (Ni, Al)7Nb6.

  14. Thermodynamic description of the Mg-Nd-Zn ternary system

    Energy Technology Data Exchange (ETDEWEB)

    Qi, H.Y.; Huang, G.X.; Bo, H.; Xu, G.L. [School of Material Science and Engineering, Central South University, Changsha, Hunan 410083 (China); Liu, L.B., E-mail: pdc@mail.csu.edu.cn [School of Material Science and Engineering, Central South University, Changsha, Hunan 410083 (China); Education Ministry Key Laboratory of Non-ferrous Materials Science and Engineering, Central South University, Changsha, Hunan 410083 (China); Center of Phase Diagram and Materials Design and Manufacture, Changsha, Hunan 410083 (China); Jin, Z.P. [School of Material Science and Engineering, Central South University, Changsha, Hunan 410083 (China); Education Ministry Key Laboratory of Non-ferrous Materials Science and Engineering, Central South University, Changsha, Hunan 410083 (China); Center of Phase Diagram and Materials Design and Manufacture, Changsha, Hunan 410083 (China)

    2011-02-17

    A thermodynamic description of the Mg-Nd-Zn system was developed by means of the CALPHAD (CALculation of PHAse Diagrams) method. The constituent binary systems Mg-Nd and Nd-Zn were re-optimized based on the experimental phase equilibria and thermodynamic properties available in the literature. Combining with the thermodynamic parameters of the Mg-Zn system cited from the reference, the Mg-Nd-Zn ternary system was evaluated. The Gibbs energies of the solution phases (liquid, BCC{sub A}2, DHCP, HCP{sub A}3 and HCP{sub Z}n) were described by the subregular solution model with the Redlich-Kister polynomial function, and those of the stoichiometric compounds, Nd{sub 2}Zn{sub 17}, NdZn{sub 11H}, NdZn{sub 11L}, Nd{sub 3}Zn{sub 22}, Nd{sub 13}Zn{sub 58}, Nd{sub 3}Zn{sub 11}, NdZn{sub 3}, NdZn{sub 2} and Mg{sub 2}Nd, were described by the sublattice model. The compounds Mg{sub 3}Nd and Mg{sub 41}Nd{sub 5} in the Mg-Nd-Zn system were treated as the formulae (Mg, Zn){sub 3}(Mg, Nd) and (Mg, Nd, Zn){sub 41}(Mg, Nd){sub 5}. The order-disorder transition between BCC{sub B}2 and BCC{sub A}2 phases was treated using a two-sublattice model (Mg, Nd, Zn){sub 0.5}(Mg, Nd, Zn){sub 0.5}. Based on experimental data, four stable ternary compounds {tau}{sub 1}(Mg{sub 7}Nd{sub 1}Zn{sub 12}), {tau}{sub 2}(Mg{sub 7}Nd{sub 2}Zn{sub 11}), {tau}{sub 3}(Mg{sub 6}Nd{sub 1}Zn{sub 3}) and {tau}{sub 4}(Mg{sub 6}Nd{sub 3}Zn{sub 11}) were taken into consideration in this system. A set of self-consistent thermodynamic parameters of the Mg-Nd-Zn system was obtained. Projection of the liquidus surface, selected vertical and isothermal sections were calculated using the proposed thermodynamic description. Comprehensive comparisons between the calculated and measured phase diagrams show that almost all the accurate experimental information is satisfactorily accounted for by the present thermodynamic description.

  15. Reduced ternary molybdenum and tungsten sulfides and hydroprocessing catalysis therewith

    Science.gov (United States)

    Hilsenbeck, Shane J.; McCarley, Robert E.; Schrader, Glenn L.; Xie, Xiaobing

    1999-02-16

    New amorphous molybdenum/tungsten sulfides with the general formula M.sup.n+.sub.2x/n (L.sub.6 S.sub.8)S.sub.x, where L is molybdenum or tungsten and M is a ternary metal, has been developed. Characterization of these amorphous materials by chemical and spectroscopic methods (IR, Raman, PES) shows that the (M.sub.6 S.sub.8).sup.0 cluster units are present. Vacuum thermolysis of the amorphous Na.sub.2x (Mo.sub.6 S.sub.8)S.sub.x .multidot.yMeOH first produces poorly crystalline NaMo.sub.6 S.sub.8 by disproportionation at 800.degree. C. and well-crystallized NaMo.sub.6 S.sub.8 at .gtoreq. 900.degree. C. Ion-exchange of the sodium material in methanol with soluble M.sup.2+ and M.sup.3+ salts (M=Sn, Co, Ni, Pb, La, Ho) produces the M.sup.n+.sub.2x/n (Mo.sub.6 S.sub.8)S.sub.x .multidot.yMeOH compounds. Additionally, the new reduced ternary molybdenum sulfides with the general formula M.sup.n+.sub.2x/n Mo.sub.6 S.sub.8+x (MeOH).sub.y ›MMOS! (M=Sn, Co, Ni) is an effective hydrodesulfurization (HDS) catalyst both as-prepared and after a variety of pretreatment conditions. Under specified pretreatment conditions with flowing hydrogen gas, the SnMoS type catalyst can be stabilized, and while still amorphous, can be considered as "Chevrel phase-like" in that both contain Mo.sub.6 S.sub.8 cluster units. Furthermore, the small cation NiMoS and CoMoS type pretreated catalyst showed to be very active HDS catalysts with rates that exceeded the model unpromoted and cobalt-promoted MoS.sub.2 catalysts.

  16. Thermodynamic assessment of the Al-Mo-V ternary system

    Directory of Open Access Journals (Sweden)

    Hu B.

    2017-01-01

    Full Text Available Thermodynamic assessment of the Al-Mo-V ternary system was performed by means of the CALPHAD (CALculation of PHAse Diagram approach based on the thermodynamic descriptions of three constitutive binary systems (Al-Mo, Al-V and Mo-V as well as the experimental phase equilibria data available in the literature. The solution phases, i.e. liquid, bcc (Mo, V and fcc (Al, were described using the substitutional solution models with the Redlich-Kister equation. The binary phases in the Al-Mo and Al-V systems with the solubilities of the third element were modeled using the sublattice models. An optimal set of thermodynamic parameters for the Al-Mo-V system was obtained. Six isothermal sections at 1200, 1000, 750, 715, 675 and 630°C and liquidus projection with isotherm were calculated. The reaction scheme for the entire Al-Mo-V system was also constructed. Comparisons between the calculated and measured phase diagrams indicated that almost all the reliable experimental information was satisfactorily accounted for by the present modeling.

  17. Growth mechanism of nanowires: binary and ternary chalcogenides

    Science.gov (United States)

    Singh, N. B.; Coriell, S. R.; Su, Ching Hua; Hopkins, R. H.; Arnold, B.; Choa, Fow-Sen; Cullum, Brian

    2016-05-01

    Semiconductor nanowires exhibit very exciting optical and electrical properties including high transparency and a several order of magnitude better photocurrent than thin film and bulk materials. We present here the mechanism of nanowire growth from the melt-liquid-vapor medium. We describe preliminary results of binary and ternary selenide materials in light of recent theories. Experiments were performed with lead selenide and thallium arsenic selenide systems which are multifunctional material and have been used for detectors, acoustooptical, nonlinear and radiation detection applications. We observed that small units of nanocubes and elongated nanoparticles arrange and rearrange at moderate melt undercooling to form the building block of a nanowire. Since we avoided the catalyst, we observed self-nucleation and uncontrolled growth of wires from different places. Growth of lead selenide nanowires was performed by physical vapor transport method and thallium arsenic selenide nanowire by vapor-liquid-solid (VLS) method. In some cases very long wires (>mm) are formed. To achieve this goal experiments were performed to create situation where nanowires grew on the surface of solid thallium arsenic selenide itself.

  18. Symmetric and asymmetric ternary fission of hot nuclei

    Science.gov (United States)

    Siwek-Wilczynska, K.; Wilczynski, J.; Leegte, H. K. W.; Siemssen, R. H.; Wilschut, H. W.; Grotowski, K.; Panasiewicz, A.; Sosin, Z.; Wieloch, A.

    1993-07-01

    Emission of α particles accompanying fusion-fission processes in the 40Ar +232Th reaction at E(40Ar) = 365 MeV was studied in a wide range of in-fission-plane and out-of-plane angles. The exact determination of the emission angles of both fission fragments combined with the time-of-flight measurements allowed us to reconstruct the complete kinematics of each ternary event. The coincident energy spectra of α particles were analyzed by using predictions of the energy spectra of the statistical code cascade . The analysis clearly demonstrates emission from the composite system prior to fission, emission from fully accelerated fragments after fission, and also emission during scission. The analysis is presented for both symmetric and asymmetric fission. The results have been analyzed using a time-dependent statistical decay code and confronted with dynamical calculations based on a classical one-body dissipation model. The observed near-scission emission is consistent with evaporation from a dinuclear system just before scission and evaporation from separated fragments just after scission. The analysis suggests that the time scale of fission of the hot composite systems is long (about 7×10-20 s) and the motion during the descent to scission almost completely damped.

  19. Ternary blend cements concrete. Part II: Transport mechanism

    Directory of Open Access Journals (Sweden)

    Irassar, E. F.

    2007-03-01

    Full Text Available With today’s extensive use of cements containing two or more additions (blended cements, predicting concrete durability on the grounds of its strength alone leads to errors that may affect the service life of the resulting structures. Indeed, concrete of a given strength class can be made from different materials and proportions of widely varying durability. The present study evaluated water absorption, sorptivity and initial surface absorption in concrete made with unadditioned Portland, binary (limestone and ternary (limestone and granulated slag blend cement.En la actualidad con la utilización de cementos con dos o más adiciones (cementos compuestos predecir la durabilidad del hormigón a partir sólo de su resistencia conduce a cometer errores que pueden afectar la vida útil de las construcciones de hormigón. Pues es bien conocido que se pueden elaborar hormigones de una misma clase resistente con distintos materiales y proporciones, que podrán presentar un comportamiento durable totalmente diferente. En este trabajo se evalúa la absorción de agua, la capacidad de absorción, la absorción inicial superficial de hormigones elaborados con cemento Portland sin adición, cementos compuestos binario (caliza y ternario (escoria granulada y caliza.

  20. Phase relations in the U-Mo-Al ternary system

    Science.gov (United States)

    Noël, H.; Tougait, O.; Dubois, S.

    2009-06-01

    The phase relations in the U-Mo-Al system of quenched samples annealed at 800 °C for 2 weeks and at 400 °C for 2 months have been established using X-ray powder diffraction, scanning electron microscopy and energy dispersive spectroscopic analysis performed at room temperature. Two ternary Al-rich phases, UMo 2-xAl 20+x and U 6Mo 4+xAl 43-x are found stable at 800 °C and 400 °C. They show significant homogeneity ranges resulting from Mo/Al substitution mechanism on various mixed crystallographic sites, as evidenced by single-crystal structure refinements. Substitution of up to 25 at.% of Al by Mo atoms is also observed for UAl 2 (cubic MgCu 2-type) giving a quite large extension (UAl 2-xMo x, 0 nuclear fuel plates can be successively estimated as composed of the two- and three-phase fields equilibrium indicated on the assessment of the phase relations drawn for samples heat-treated at 400 °C.

  1. Measurements on thermodiffusion in ternary hydrocarbon mixtures at high pressure

    Science.gov (United States)

    Srinivasan, S.; Saghir, M. Z.

    2009-09-01

    Experimental investigations on thermodiffusion have been conducted for five different ternary mixtures of methane, n-butane, and n-dodecane at a high temperature and pressure. While the mole fraction of methane was fixed at 0.2 the mole fraction of n-dodecane was varied from 0.7 to 0.2. The experiments were performed in a microgravity environment on board the satellite FOTON-M3. It was found that in all mixtures, n-dodecane separated to the cold side whereas methane segregated to the hot side. n-butane, the species with an intermediate density, showed a change in sign as its mole fraction was increased. At low concentrations it collected on the cold side but moved in the opposite direction with an increase in its mole fraction. The role of the relative density coupled with the species concentrations has been used to explain the thermodiffusion factor in each mixture. Computational investigations showed a similar behavior. However, the theoretical model was not able to capture the sign change of n-butane accurately. The inadequate representation of the significance of the relative densities and the mole fraction of the species has been found as the reason for this.

  2. Lattice-matched heteroepitaxy of wide gap ternary compound semiconductors

    Science.gov (United States)

    Bachmann, Klaus J.

    1992-01-01

    A variety of applications are identified for heteroepitaxial structures of wide gap I-III-VI2 and II-IV-V2 semiconductors, and are assessed in comparison with ternary III-V alloys and other wide gap materials. Non-linear optical applications of the I-III-VI2 and II-IV-V2 compound heterostructures are discussed, which require the growth of thick epitaxial layers imposing stringent requirements on the conditions of heteroepitaxy. In particular, recent results concerning the MOCVD growth of ZnSi(x)Ge(1-x)P2 alloys lattice-matching Si or GaP substrates are reviewed. Also, heterostructures of Cu(z)Ag(1-z)GaS2 alloys that lattice-match Si, Ge, GaP or GaAs substrates are considered in the context of optoelectronic devices operating in the blue wavelength regime. Since under the conditions of MOCVD, metastable alloys of the II-IV-V2 compounds and group IV elements are realized, II-IV-V2 alloys may also serve as interlayers in the integration of silicon and germanium with exactly lattice-matched tetrahedrally coordinated compound semiconductors, e.g. ZnSi(x)Ge(1-x)P2.

  3. Alloy multilayers and ternary nanostructures by direct-write approach

    Science.gov (United States)

    Porrati, F.; Sachser, R.; Gazzadi, G. C.; Frabboni, S.; Terfort, A.; Huth, M.

    2017-10-01

    The fabrication of nanopatterned multilayers, as used in optical and magnetic applications, is usually achieved by two independent steps, which consist in the preparation of multilayer films and in the successive patterning by means of lithography and etching processes. Here we show that multilayer nanostructures can be fabricated by using focused electron beam induced deposition (FEBID), which allows the direct writing of nanostructures of any desired shape with nanoscale resolution. In particular, {[{{{Co}}}2{{Fe}}/{{Si}}]}n multilayers are prepared by the alternating deposition from the metal carbonyl precursors, {{{HFeCo}}}3{({{CO}})}12 and {{Fe}}{({{CO}})}5, and neopentasilane, {{{Si}}}5{{{H}}}12. The ability to fabricate nanopatterned multilayers by FEBID is of interest for the realization of hyperbolic metamaterials and related nanodevices. In a second experiment, we treated the multilayers by low-energy electron irradiation in order to induce atomic species intermixing with the purpose to obtain ternary nanostructured compounds. Transmission electron microscopy and electrical transport measurements indicate that in thick multilayers, (n = 12), the intermixing is only partial, taking place mainly in the upper part of the structures. However, for thin multilayers, (n = 2), the intermixing is such that a transformation into the L21 phase of the Co2FeSi Heusler compound takes place over the whole sample volume.

  4. THE INTERFACE OF TERNARY-BORIDE-BASED HARD CLADDING MATERIAL

    Institute of Scientific and Technical Information of China (English)

    Y.G. Wang; Z.Q. Li; D. Zhang

    2004-01-01

    The interfacial microstructure of ternary-boride-based hard cladding material (YF2) has been studied using scanning electron microanalyser (SEM), X-ray diffraction (XRD) and energy disperse spectroscopy (EDS). Results show that there are chemical reactions and elements diffusion in the interfacial zone, which make the interface bonding well and bonding strength ideal at the interface. The results gotten by studying of crack produced by Vickers indentation technique in the interfacial zone show that it is difficult to produce crack in the interface, the crack length in the cladding layer is longer than that to the interface, the crack which propagate to the interface stops at the interface rather than propagates along the interface. This suggests negligible residual stresses have developed because of thermal expansion mismatch. The bonding strength of the interface is 550MPa, which has been gotten by cutting test. The result gotten by analyzing the fracture surface shows that the fracture occurs at the side of cladding layer, which confirms that the bonding strength at the interface is higher than that in the cladding layer.

  5. Critical temperature of a mixed ferro-ferrimagnetic ternary alloy

    Science.gov (United States)

    Dely, Ján; Bobák, Andrej; Žukovič, Milan

    2010-01-01

    We study the critical properties of a mixed ferro-ferrimagnetic ternary alloy of the type ABpC1-p on a cubic lattice consisting of three different Ising spins SA = 3/2, SB = 2, and SC = 5/2. The A ions are linked with either the B or C ions which are randomly distributed in the lattice with the concentration p or 1-p, respectively. The exchange interactions between nearest neighbours only, JAB > 0 and JAC JAC|JAB and concentration p on the critical behaviour of the system are investigated and the results from both methods are compared. We find that the critical temperature of the mixed ferro-ferrimagnet for a special value of R does not depend on the concentration p. The relation between the studied model and the structure of the Prussian blue analog such as (Fe11pMn111-p)1.5[Cr111(CN)6] · nH2O is also discussed.

  6. Ternary Content Addressable Memory Types And Matchline Schemes

    Directory of Open Access Journals (Sweden)

    Sulthana A

    2015-03-01

    Full Text Available Ternary Content Addressable Memory (TCAM used in many application like network routers and packet classification. To reduce the power consumption of matchlines, the matchline partitioning scheme is used. Matchline is partitioned into NOR and NAND type matchline. If NAND (NOR type TCAM cell is used then NAND (NOR type matchline is used. NOR type TCAM has feature of high speed and high compare power. NAND type TCAM has low speed and low compare power. The NAND and NOR type matchlines are combined to form the pai-sigma matchlines. In pai segment the NAND type cells are connected in parallel to form the NAND type matchline. In sigma segment NOR type cells are connected in series to form the NOR type matchline. When compare operation is performed all NAND type matchlines are activated because switching power is low. Based on the match result of the NAND matchlines the NOR matchlines are activated because of high speed. The matchline incurs the problem of short circuit current due to mismatch and match result of NAND and NOR matchlines. NAND type matchline exist the problem of charge sharing when the search result of the NAND line is mismatches. This proposed TCAM has less compare (search power compared to the NAND/NOR type TCAM cell.

  7. Control mechanism of double-rotator-structure ternary optical computer

    Science.gov (United States)

    Kai, SONG; Liping, YAN

    2017-03-01

    Double-rotator-structure ternary optical processor (DRSTOP) has two characteristics, namely, giant data-bits parallel computing and reconfigurable processor, which can handle thousands of data bits in parallel, and can run much faster than computers and other optical computer systems so far. In order to put DRSTOP into practical application, this paper established a series of methods, namely, task classification method, data-bits allocation method, control information generation method, control information formatting and sending method, and decoded results obtaining method and so on. These methods form the control mechanism of DRSTOP. This control mechanism makes DRSTOP become an automated computing platform. Compared with the traditional calculation tools, DRSTOP computing platform can ease the contradiction between high energy consumption and big data computing due to greatly reducing the cost of communications and I/O. Finally, the paper designed a set of experiments for DRSTOP control mechanism to verify its feasibility and correctness. Experimental results showed that the control mechanism is correct, feasible and efficient.

  8. Transmission properties of one-dimensional ternary plasma photonic crystals

    Energy Technology Data Exchange (ETDEWEB)

    Shiveshwari, Laxmi [Department of Physics, K. B. Womens' s College, Hazaribagh 825 301 (India); Awasthi, S. K. [Department of Physics and Material Science and Engineering, Jaypee Institute of Information Technology, Noida 201 304 (India)

    2015-09-15

    Omnidirectional photonic band gaps (PBGs) are found in one-dimensional ternary plasma photonic crystals (PPC) composed of single negative metamaterials. The band characteristics and transmission properties are investigated through the transfer matrix method. We show that the proposed structure can trap light in three-dimensional space due to the elimination of Brewster's angle transmission resonance allowing the existence of complete PBG. The results are discussed in terms of incident angle, layer thickness, dielectric constant of the dielectric material, and number of unit cells (N) for TE and TM polarizations. It is seen that PBG characteristics is apparent even in an N ≥ 2 system, which is weakly sensitive to the incident angle and completely insensitive to the polarization. Finite PPC could be used for multichannel transmission filter without introducing any defect in the geometry. We show that the locations of the multichannel transmission peaks are in the allowed band of the infinite structure. The structure can work as a single or multichannel filter by varying the number of unit cells. Binary PPC can also work as a polarization sensitive tunable filter.

  9. Ion Beam Nanostructuring of HgCdTe Ternary Compound

    Science.gov (United States)

    Smirnov, Aleksey B.; Savkina, Rada K.; Udovytska, Ruslana S.; Gudymenko, Oleksandr I.; Kladko, Vasyl P.; Korchovyi, Andrii A.

    2017-05-01

    Systematic study of mercury cadmium telluride thin films subjected to the ion beam bombardment was carried out. The evolution of surface morphology of (111) Hg1 - x Cd x Te ( x 0.223) epilayers due to 100 keV B+ and Ag+ ion irradiation was studied by AFM and SEM methods. X-ray photoelectron spectroscopy and X-ray diffraction methods were used for the investigation of the chemical compound and structural properties of the surface and subsurface region. It was found that in the range of nanoscale, arrays of holes and mounds on Hg0.777Cd0.223Te (111) surface as well as the polycrystalline Hg1 - x Cd x Te cubic phase with alternative compound ( x 0.20) have been fabricated using 100 keV ion beam irradiation of the basic material. Charge transport investigation with non-stationary impedance spectroscopy method has shown that boron-implanted structures are characterized by capacity-type impedance whereas for silver-implanted structures, an inductive-type impedance (or "negative capacitance") is observed. A hybrid system, which integrates the nanostructured ternary compound (HgCdTe) with metal-oxide (Ag2O) inclusions, was fabricated by Ag+ ion bombardment. The sensitivity of such metal-oxide-semiconductor hybrid structure for sub-THz radiation was detected with NEP 4.5 × 10-8 W/Hz1/2at ν ≈ 140 GHz and 296 K without amplification.

  10. Ternary Phase Diagrams that Relate to the Plutonium Immobilization Ceramic

    Energy Technology Data Exchange (ETDEWEB)

    Ebbinghaus, B b; Krikorian, O H; Vance, E R; Stewart, M W

    2001-01-01

    The plutonium immobilization ceramic consists primarily of a pyrochlore titanate phase of the approximate composition Ca{sub 0.97}Hf{sub 0.17}Pu{sub 0.22}U{sub 0.39}Gd{sub 0.24} Ti{sub 2}O{sub 7}. In this study, a series of ternary phase diagrams was constructed to evaluate the relationship of various titanate phases (e.g., brannerite, zirconolite-2M, zirconolite-4M, and perovskite) to pyrochlore titanates, usually in the presence of excess TiO{sub 2} (rutile), and at temperatures in the vicinity of 1350 C. To facilitate the studies, U, Th, and Ce were used as surrogates for Pu in a number of the phase diagrams in addition to the use of Pu itself. The effects of impurity oxides, Al{sub 2}O{sub 3} and MgO, were also studied on pyrochlore (Gd{sub 2}Ti{sub 2}O{sub 7}) and zirconolite (CaHfTi{sub 2}O{sub 7}) mixtures. Either electron microprobe (at Lawrence Livermore National Laboratory) or quantitative SEM-EDS (at Australian Nuclear Science and Technology Organization) were used to evaluate the compositions of the phases.

  11. Iron binary and ternary coatings with molybdenum and tungsten

    Energy Technology Data Exchange (ETDEWEB)

    Yar-Mukhamedova, Gulmira, E-mail: gulmira-alma-ata@mail.ru [Institute Experimental and Theoretical Physics Al-Farabi Kazakh National University, 050038, Al-Farabi av., 71, Almaty (Kazakhstan); Ved, Maryna; Sakhnenko, Nikolay; Karakurkchi, Anna; Yermolenko, Iryna [National Technical University “Kharkov Polytechnic Institute”, Kharkov (Ukraine)

    2016-10-15

    Highlights: • High quality coatings of double Fe-Mo and ternary Fe-Mo-W electrolytic alloys can be produced both in a dc and a pulsed mode. • Application of unipolar pulsed current allows receiving an increased content of the alloying components and their more uniform distribution over the surface. • It is established that Fe-Mo and Fe-Mo-W coatings have an amorphous structure and exhibit improved corrosion resistance and microhardness as compared with the steel substrate due to the inclusion molybdenum and tungsten. - Abstract: Electrodeposition of Fe-Mo-W and Fe-Mo layers from a citrate solution containing iron(III) on steel and iron substrates is compared. The utilization of iron(III) compounds significantly improved the electrolyte stability eliminating side anodic redox reactions. The influence of concentration ratios and electrodeposition mode on quality, chemical composition, and functional properties of the alloys is determined. It has been found that alloys deposited in pulse mode have more uniform surface morphology and chemical composition and contain less impurities. Improvement in physical and mechanical properties as well as corrosion resistance of Fe-Mo and Fe-Mo-W deposits when compared with main alloy forming metals is driven by alloying components chemical passivity as well as by alloys amorphous structure. Indicated deposits can be considered promising materials in surface hardening technologies and repair of worn out items.

  12. Delay Insensitive Ternary CMOS Logic for Secure Hardware

    Directory of Open Access Journals (Sweden)

    Ravi S. P. Nair

    2015-09-01

    Full Text Available As digital circuit design continues to evolve due to progress of semiconductor processes well into the sub 100 nm range, clocked architectures face limitations in a number of cases where clockless asynchronous architectures generate less noise and produce less electro-magnetic interference (EMI. This paper develops the Delay-Insensitive Ternary Logic (DITL asynchronous design paradigm that combines design aspects of similar dual-rail asynchronous paradigms and Boolean logic to create a single wire per bit, three voltage signaling and logic scheme. DITL is compared with other delay insensitive paradigms, such as Pre-Charge Half-Buffers (PCHB and NULL Convention Logic (NCL on which it is based. An application of DITL is discussed in designing secure digital circuits resistant to side channel attacks based on measurement of timing, power, and EMI signatures. A Secure DITL Adder circuit is designed at the transistor level, and several variance parameters are measured to validate the efficiency of DITL in resisting side channel attacks. The DITL design methodology is then applied to design a secure 8051 ALU.

  13. Structure of an argonaute silencing complex with a seed-containing guide DNA and target RNA duplex

    Energy Technology Data Exchange (ETDEWEB)

    Wang, Yanli; Juranek, Stefan; Li, Haitao; Sheng, Gang; Tuschl, Thomas; Patel, Dinshaw J. (MSKCC); (HHMI)

    2009-01-08

    Here we report on a 3.0 {angstrom} crystal structure of a ternary complex of wild-type Thermus thermophilus argonaute bound to a 5'-phosphorylated 21-nucleotide guide DNA and a 20-nucleotide target RNA containing cleavage-preventing mismatches at the 10-11 step. The seed segment (positions 2 to 8) adopts an A-helical-like Watson-Crick paired duplex, with both ends of the guide strand anchored in the complex. An arginine, inserted between guide-strand bases 10 and 11 in the binary complex, locking it in an inactive conformation, is released on ternary complex formation. The nucleic-acid-binding channel between the PAZ- and PIWI-containing lobes of argonaute widens on formation of a more open ternary complex. The relationship of structure to function was established by determining cleavage activity of ternary complexes containing position-dependent base mismatch, bulge and 2'-O-methyl modifications. Consistent with the geometry of the ternary complex, bulges residing in the seed segments of the target, but not the guide strand, were better accommodated and their complexes were catalytically active.

  14. Ternary Blend Composed of Two Organic Donors and One Acceptor for Active Layer of High-Performance Organic Solar Cells.

    Science.gov (United States)

    Lee, Jong Won; Choi, Yoon Suk; Ahn, Hyungju; Jo, Won Ho

    2016-05-04

    Ternary blends composed of two donor absorbers with complementary absorptions provide an opportunity to enhance the short-circuit current and thus the power conversion efficiency (PCE) of organic solar cells. In addition to complementary absorption of two donors, ternary blends may exhibit favorable morphology for high-performance solar cells when one chooses properly the donor pair. For this purpose, we develop a ternary blend with two donors (diketopyrrolopyrrole-based polymer (PTDPP2T) and small molecule ((TDPP)2Ph)) and one acceptor (PC71BM). The solar cell made of a ternary blend with 10 wt % (TDPP)2Ph exhibits higher PCE of 7.49% as compared with the solar cells with binary blends, PTDPP2T:PC71BM (6.58%) and (TDPP)2Ph:PC71BM (3.21%). The higher PCE of the ternary blend solar cell is attributed mainly to complementary absorption of two donors. However, a further increase in (TDPP)2Ph content in the ternary blend (>10 wt %) decreases the PCE. The ternary blend with 10 wt % (TDPP)2Ph exhibits well-developed morphology with narrow-sized fibrils while the blend with 15 wt % (TDPP)2Ph shows phase separation with large-sized domains, demonstrating that the phase morphology and compatibility of ternary blend are important factors to achieve a high-performance solar cell made of ternary blends.

  15. Cluster description of cold (neutronless) α ternary fission of 252Cf

    Science.gov (United States)

    Săndulescu, A.; Carstoiu, F.; Bulboacă, I.; Greiner, W.

    1999-10-01

    A coplanar three body cluster model (two deformed fragments and an α particle) similar to the model used for the description of cold binary fission was employed for the description of cold (neutronless) α accompanied fission of 252Cf. No preformation factors were considered. The three body potential was computed with the help of a double folding potential generated by the M3Y-NN effective interaction and realistic fragment ground state deformations. From the minimum action principle, the α particle trajectory equations, the corresponding ternary barriers, and an approximate WKB expression for the barrier penetrability are obtained. The relative cold ternary yields were calculated as the ratio of the penetrability of a given ternary fragmentation and the sum of the penetrabilities of all possible cold ternary fragmentations. Different scenarios were considered depending on the trajectories of the fragments. It was shown that two regions of cold fragmentation exist, a deformed one corresponding to large fragment deformations and a spherical one around 132Sn, similarly to the case of the cold binary fission of 252Cf. We have shown that for the scenario corresponding to the Lagrange point, where all forces acting on the α particle are in equilibrium, the cold α ternary yields of 252Cf are strongly correlated with the cold binary yields of the daughter nucleus 248Cm into the same heavy fragments. For all other scenarios only the spherical splittings are favored. We concluded that due to the present available experimental data on cold α ternary yields only the Lagrange scenario could describe the cold α ternary fission of 252Cf.

  16. Measurement of zinc activity in the ternary In–Zn–Sn alloys by EMF method

    Energy Technology Data Exchange (ETDEWEB)

    Behera, C.K., E-mail: ckbehera.met@itbhu.ac.in; Sonaye, A.

    2013-09-20

    Highlights: • Activity of zinc in the ternary In–Zn–Sn system has been measured in the temperature range 753–853 K by EMF method. • Isoactivity lines for zinc reflect the positive deviation from the ideality at 813 K. • The activity of indium in In–Sn binary system shows negative deviation from Raoult's law over entire range of composition. • Ternary excess molar free energies at 813 K are computed by Darken's treatment. • Calculated molar excess free energies for the ternary systems are compared with the Chou's theoretical model data. - Abstract: Activity of zinc in liquid In–Zn–Sn alloys has been measured by electrochemical technique based on molten salt electrolyte galvanic cell in the temperature range 753–853 K along three ternary sections of Zn{sub x}(In{sub y}Sn{sub 1−y}){sub 1−x} where y = 0.67, 0.50 and 0.33. The activity of indium in In–Sn binary alloys has also been measured by the same technique in the same temperature range. The activity of Zinc in In–Zn–Sn alloys shows positive deviation from the Raoult's law over entire range of composition. The activity of indium in In–Sn alloys shows negative deviations from ideality for entire composition. The excess molar free energies have been computed by the Darken's treatment of the ternary solutions using In–Sn binary data and ternary data in this study. Isoactivity curves at 813 K in the ternary In–Zn–Sn alloys were derived by combining the activity data of In–Zn and Sn–Zn alloys. The values of excess molar free energy in this study are in good agreement with those calculated from the general model calculation proposed by Chou.

  17. Ternary Phases (Heusler) in the System Ti-Co-Sn

    Science.gov (United States)

    Kosinskiy, Andrey; Karlsen, Ole Bjørn; Sørby, Magnus H.; Prytz, Øystein

    2016-09-01

    Some of the Heusler-phases (XY 2 Z and XYZ) are known to have large homogeneity ranges which can be useful for tuning material properties. In this work, we have revised the isothermal section of the Ti-Co-Sn system at 973 K (700 °C). A total of 29 ternary compositions, mostly in the regions TiCo2-x Sn for 0 ≤ x ≤ 1 and Ti1+y Co2Sn1-y for 0 ≤ y ≤ 1, were prepared by arc-melting, then ball-milled and annealed. The resulting annealed powder samples were studied by applying the Rietveld method to X-ray and neutron powder diffraction data. Half-Heusler TiCoSn was not observed. The Heusler phase observed in TiCo2-x Sn has compositions ranging from TiCo1.52Sn to TiCo2Sn and has the half-Heusler structure where the excess of Co is located on the semi-filled tetrahedral site 4d (¾, ¾, ¾) in the space group F-43m. At 1273 K (1000 °C), this solid solubility is expanded from TiCo2Sn to TiCo with full solid solubility where Ti is gradually replacing Sn (Ti1+y Co2Sn1-y for 0 ≤ y ≤ 1), while at 973 K (700 °C) there is a small solubility gap for 0.0 ≤ y ≤ 0.2.

  18. Review of Reactivity Experiments for Lithium Ternary Alloys

    Energy Technology Data Exchange (ETDEWEB)

    Jolodosky, A. [Univ. of California, Berkeley, CA (United States); Bolind, A. [Univ. of California, Berkeley, CA (United States); Fratoni, M. [Univ. of California, Berkeley, CA (United States)

    2015-09-28

    Lithium is often the preferred choice as breeder and coolant in fusion blankets as it offers high tritium breeding, excellent heat transfer and corrosion properties, and most importantly, it has very high tritium solubility and results in very low levels of tritium permeation throughout the facility infrastructure. However, lithium metal vigorously reacts with air and water and exacerbates plant safety concerns. Consequently, Lawrence Livermore National Laboratory (LLNL) is attempting to develop a lithium-based alloy—most likely a ternary alloy—which maintains the beneficial properties of lithium (e.g. high tritium breeding and solubility) while reducing overall flammability concerns for use in the blanket of an inertial fusion energy (IFE) power plant. The LLNL concept employs inertial confinement fusion (ICF) through the use of lasers aimed at an indirect-driven target composed of deuterium-tritium fuel. The fusion driver/target design implements the same physics currently experimented at the National Ignition Facility (NIF). The plant uses lithium in both the primary coolant and blanket; therefore, lithium related hazards are of primary concern. Reducing chemical reactivity is the primary motivation for the development of new lithium alloys, and it is therefore important to come up with proper ways to conduct experiments that can physically study this phenomenon. This paper will start to explore this area by outlining relevant past experiments conducted with lithium/air reactions and lithium/water reactions. Looking at what was done in the past will then give us a general idea of how we can setup our own experiments to test a variety of lithium alloys.

  19. Ternary eutectic dendrites: Pattern formation and scaling properties

    Energy Technology Data Exchange (ETDEWEB)

    Rátkai, László; Szállás, Attila; Pusztai, Tamás [Institute for Solid State Physics and Optics, Wigner Research Centre for Physics, P.O. Box 49, H-1525 Budapest (Hungary); Mohri, Tetsuo [Center for Computational Materials Science, Institute for Materials Research, Tohoku University, 2-1-1 Katahira, Aoba-ku, Sendai 980-8577 (Japan); Gránásy, László, E-mail: granasy.laszlo@wigner.mta.hu [Institute for Solid State Physics and Optics, Wigner Research Centre for Physics, P.O. Box 49, H-1525 Budapest (Hungary); Brunel University, Uxbridge, Middlesex UB8 3PH (United Kingdom)

    2015-04-21

    Extending previous work [Pusztai et al., Phys. Rev. E 87, 032401 (2013)], we have studied the formation of eutectic dendrites in a model ternary system within the framework of the phase-field theory. We have mapped out the domain in which two-phase dendritic structures grow. With increasing pulling velocity, the following sequence of growth morphologies is observed: flat front lamellae → eutectic colonies → eutectic dendrites → dendrites with target pattern → partitionless dendrites → partitionless flat front. We confirm that the two-phase and one-phase dendrites have similar forms and display a similar scaling of the dendrite tip radius with the interface free energy. It is also found that the possible eutectic patterns include the target pattern, and single- and multiarm spirals, of which the thermal fluctuations choose. The most probable number of spiral arms increases with increasing tip radius and with decreasing kinetic anisotropy. Our numerical simulations confirm that in agreement with the assumptions of a recent analysis of two-phase dendrites [Akamatsu et al., Phys. Rev. Lett. 112, 105502 (2014)], the Jackson-Hunt scaling of the eutectic wavelength with pulling velocity is obeyed in the parameter domain explored, and that the natural eutectic wavelength is proportional to the tip radius of the two-phase dendrites. Finally, we find that it is very difficult/virtually impossible to form spiraling two-phase dendrites without anisotropy, an observation that seems to contradict the expectations of Akamatsu et al. Yet, it cannot be excluded that in isotropic systems, two-phase dendrites are rare events difficult to observe in simulations.

  20. Electrochemical combustion of indigo at ternary oxide coated titanium anodes

    Directory of Open Access Journals (Sweden)

    María I. León

    2014-12-01

    Full Text Available The film of iridium and tin dioxides doped with antimony (IrO2-SnO2–Sb2O5 deposited on a Ti substrate (mesh obtained by Pechini method was used for the formation of ·OH radicals by water discharge. Detection of ·OH radicals was followed by the use of the N,N-dimethyl-p-nitrosoaniline (RNO as a spin trap. The electrode surface morphology and composition was characterized by SEM-EDS. The ternary oxide coating was used for the electrochemical combustion of indigo textile dye as a model organic compound in chloride medium. Bulk electrolyses were then carried out at different volumetric flow rates under galvanostatic conditions using a filter-press flow cell. The galvanostatic tests using RNO confirmed that Ti/IrO2-SnO2-Sb2O5 favor the hydroxyl radical formation at current densities between 5 and 7 mA cm-2, while at current density of 10 mA cm-2 the oxygen evolution reaction occurs. The indigo was totally decolorized and mineralized via reactive oxygen species, such as (·OH, H2O2, O3 and active chlorine formed in-situ at the Ti/IrO2-SnO2-Sb2O5 surface at volumetric flow rates between 0.1-0.4 L min-1 and at fixed current density of 7 mA cm-2. The mineralization of indigo carried out at 0.2 L min-1 achieved values of 100 %, with current efficiencies of 80 % and energy consumption of 1.78 KWh m-3.