WorldWideScience

Sample records for exchange protein-ligand systems

  1. Identification of individual protein-ligand NOEs in the limit of intermediate exchange

    International Nuclear Information System (INIS)

    Reibarkh, Mikhail; Malia, Thomas J.; Hopkins, Brian T.; Wagner, Gerhard

    2006-01-01

    Interactions of proteins with small molecules or other macromolecules play key roles in many biological processes and in drug action, and NMR is an excellent tool for their structural characterization. Frequently, however, line broadening due to intermediate exchange completely eliminates the signals needed for measuring specific intermolecular NOEs. This limits the use of NMR for detailed structural studies in such kinetic situations. Here we show that an optimally chosen excess of ligand over protein can reduce the extent of line broadening for both the ligand and the protein. This makes observation of ligand resonances possible but reduces the size of the measurable NOEs due to the residual line broadening and the non-stoichiometric concentrations. Because the solubility of small molecule drug leads are often limited to high micromolar concentrations, protein concentrations are restricted to even lower values in the low micromolar range. At these non-stoichiometric concentrations and in the presence of significant residual line broadening, conventional NOESY experiments very often are not sensitive enough to observe intermolecular NOEs since the signals inverted by the NOESY preparation pulse sequence relax prior to significant NOE build up. Thus, we employ methods related to driven NOE spectroscopy to investigate protein-ligand interactions in the intermediate exchange regime. In this approach, individual protein resonances are selectively irradiated for up to five seconds to build up measurable NOEs at the ligand resonances. To enable saturation of individual protein resonances we prepare deuterated protein samples selectively protonated at a few sites so that the 1D 1 H spectrum of the protein is resolved well enough to permit irradiation of individual protein signals, which do not overlap with the ligand spectrum. This approach is suitable for measuring a sufficiently large number of protein-ligand NOEs that allow calculation of initial complex structures

  2. In Silico Generation of Peptides by Replica Exchange Monte Carlo: Docking-Based Optimization of Maltose-Binding-Protein Ligands.

    Directory of Open Access Journals (Sweden)

    Anna Russo

    Full Text Available Short peptides can be designed in silico and synthesized through automated techniques, making them advantageous and versatile protein binders. A number of docking-based algorithms allow for a computational screening of peptides as binders. Here we developed ex-novo peptides targeting the maltose site of the Maltose Binding Protein, the prototypical system for the study of protein ligand recognition. We used a Monte Carlo based protocol, to computationally evolve a set of octapeptides starting from a polialanine sequence. We screened in silico the candidate peptides and characterized their binding abilities by surface plasmon resonance, fluorescence and electrospray ionization mass spectrometry assays. These experiments showed the designed binders to recognize their target with micromolar affinity. We finally discuss the obtained results in the light of further improvement in the ex-novo optimization of peptide based binders.

  3. Locating binding poses in protein-ligand systems using reconnaissance metadynamics

    Science.gov (United States)

    Söderhjelm, Pär; Tribello, Gareth A.; Parrinello, Michele

    2012-01-01

    A molecular dynamics-based protocol is proposed for finding and scoring protein-ligand binding poses. This protocol uses the recently developed reconnaissance metadynamics method, which employs a self-learning algorithm to construct a bias that pushes the system away from the kinetic traps where it would otherwise remain. The exploration of phase space with this algorithm is shown to be roughly six to eight times faster than unbiased molecular dynamics and is only limited by the time taken to diffuse about the surface of the protein. We apply this method to the well-studied trypsin–benzamidine system and show that we are able to refind all the poses obtained from a reference EADock blind docking calculation. These poses can be scored based on the length of time the system remains trapped in the pose. Alternatively, one can perform dimensionality reduction on the output trajectory and obtain a map of phase space that can be used in more expensive free-energy calculations. PMID:22440749

  4. A sequence-based dynamic ensemble learning system for protein ligand-binding site prediction

    KAUST Repository

    Chen, Peng

    2015-12-03

    Background: Proteins have the fundamental ability to selectively bind to other molecules and perform specific functions through such interactions, such as protein-ligand binding. Accurate prediction of protein residues that physically bind to ligands is important for drug design and protein docking studies. Most of the successful protein-ligand binding predictions were based on known structures. However, structural information is not largely available in practice due to the huge gap between the number of known protein sequences and that of experimentally solved structures

  5. A sequence-based dynamic ensemble learning system for protein ligand-binding site prediction

    KAUST Repository

    Chen, Peng; Hu, ShanShan; Zhang, Jun; Gao, Xin; Li, Jinyan; Xia, Junfeng; Wang, Bing

    2015-01-01

    Background: Proteins have the fundamental ability to selectively bind to other molecules and perform specific functions through such interactions, such as protein-ligand binding. Accurate prediction of protein residues that physically bind to ligands is important for drug design and protein docking studies. Most of the successful protein-ligand binding predictions were based on known structures. However, structural information is not largely available in practice due to the huge gap between the number of known protein sequences and that of experimentally solved structures

  6. [Supercomputer investigation of the protein-ligand system low-energy minima].

    Science.gov (United States)

    Oferkin, I V; Sulimov, A V; Katkova, E V; Kutov, D K; Grigoriev, F V; Kondakova, O A; Sulimov, V B

    2015-01-01

    The accuracy of the protein-ligand binding energy calculations and ligand positioning is strongly influenced by the choice of the docking target function. This work demonstrates the evaluation of the five different target functions used in docking: functions based on MMFF94 force field and functions based on PM7 quantum-chemical method accounting or without accounting the implicit solvent model (PCM, COSMO or SGB). For these purposes the ligand positions corresponding to the minima of the target function and the experimentally known ligand positions in the protein active site (crystal ligand positions) were compared. Each function was examined on the same test-set of 16 protein-ligand complexes. The new parallelized docking program FLM based on Monte Carlo search algorithm was developed to perform the comprehensive low-energy minima search and to calculate the protein-ligand binding energy. This study demonstrates that the docking target function based on the MMFF94 force field can be used to detect the crystal or near crystal positions of the ligand by the finding the low-energy local minima spectrum of the target function. The importance of solvent accounting in the docking process for the accurate ligand positioning is also shown. The accuracy of the ligand positioning as well as the correlation between the calculated and experimentally determined protein-ligand binding energies are improved when the MMFF94 force field is substituted by the new PM7 method with implicit solvent accounting.

  7. A general approach for developing system-specific functions to score protein-ligand docked complexes using support vector inductive logic programming.

    Science.gov (United States)

    Amini, Ata; Shrimpton, Paul J; Muggleton, Stephen H; Sternberg, Michael J E

    2007-12-01

    Despite the increased recent use of protein-ligand and protein-protein docking in the drug discovery process due to the increases in computational power, the difficulty of accurately ranking the binding affinities of a series of ligands or a series of proteins docked to a protein receptor remains largely unsolved. This problem is of major concern in lead optimization procedures and has lead to the development of scoring functions tailored to rank the binding affinities of a series of ligands to a specific system. However, such methods can take a long time to develop and their transferability to other systems remains open to question. Here we demonstrate that given a suitable amount of background information a new approach using support vector inductive logic programming (SVILP) can be used to produce system-specific scoring functions. Inductive logic programming (ILP) learns logic-based rules for a given dataset that can be used to describe properties of each member of the set in a qualitative manner. By combining ILP with support vector machine regression, a quantitative set of rules can be obtained. SVILP has previously been used in a biological context to examine datasets containing a series of singular molecular structures and properties. Here we describe the use of SVILP to produce binding affinity predictions of a series of ligands to a particular protein. We also for the first time examine the applicability of SVILP techniques to datasets consisting of protein-ligand complexes. Our results show that SVILP performs comparably with other state-of-the-art methods on five protein-ligand systems as judged by similar cross-validated squares of their correlation coefficients. A McNemar test comparing SVILP to CoMFA and CoMSIA across the five systems indicates our method to be significantly better on one occasion. The ability to graphically display and understand the SVILP-produced rules is demonstrated and this feature of ILP can be used to derive hypothesis for

  8. Quantitative analysis of protein-ligand interactions by NMR.

    Science.gov (United States)

    Furukawa, Ayako; Konuma, Tsuyoshi; Yanaka, Saeko; Sugase, Kenji

    2016-08-01

    Protein-ligand interactions have been commonly studied through static structures of the protein-ligand complex. Recently, however, there has been increasing interest in investigating the dynamics of protein-ligand interactions both for fundamental understanding of the underlying mechanisms and for drug development. NMR is a versatile and powerful tool, especially because it provides site-specific quantitative information. NMR has widely been used to determine the dissociation constant (KD), in particular, for relatively weak interactions. The simplest NMR method is a chemical-shift titration experiment, in which the chemical-shift changes of a protein in response to ligand titration are measured. There are other quantitative NMR methods, but they mostly apply only to interactions in the fast-exchange regime. These methods derive the dissociation constant from population-averaged NMR quantities of the free and bound states of a protein or ligand. In contrast, the recent advent of new relaxation-based experiments, including R2 relaxation dispersion and ZZ-exchange, has enabled us to obtain kinetic information on protein-ligand interactions in the intermediate- and slow-exchange regimes. Based on R2 dispersion or ZZ-exchange, methods that can determine the association rate, kon, dissociation rate, koff, and KD have been developed. In these approaches, R2 dispersion or ZZ-exchange curves are measured for multiple samples with different protein and/or ligand concentration ratios, and the relaxation data are fitted to theoretical kinetic models. It is critical to choose an appropriate kinetic model, such as the two- or three-state exchange model, to derive the correct kinetic information. The R2 dispersion and ZZ-exchange methods are suitable for the analysis of protein-ligand interactions with a micromolar or sub-micromolar dissociation constant but not for very weak interactions, which are typical in very fast exchange. This contrasts with the NMR methods that are used

  9. THERMODYNAMICS OF PROTEIN-LIGAND INTERACTIONS AND THEIR ANALYSIS

    Directory of Open Access Journals (Sweden)

    Rummi Devi Saini

    2017-11-01

    Full Text Available Physiological processes are controlled mainly by intermolecular recognition mechanisms which involve protein–protein and protein–ligand interactions with a high specificity and affinity to form a specific complex. Proteins being an important class of macromolecules in biological systems, it is important to understand their actions through binding to other molecules of proteins or ligands. In fact, the binding of low molecular weight ligands to proteins plays a significant role in regulating biological processes such as cellular metabolism and signal transmission. Therefore knowledge of the protein–ligand interactions and the knowledge of the mechanisms involved in the protein-ligand recognition and binding are key in understanding biology at molecular level which will facilitate the discovery, design, and development of drugs. In this review, the mechanisms involved in protein–ligand binding, the binding kinetics, thermodynamic concepts and binding driving forces are discussed. Thermodynamic mechanisms involved in a few important protein-ligand binding are described. Various spectroscopic, non-spectroscopic and computational method for analysis of protein–ligand binding are also discussed.

  10. Cloud computing for protein-ligand binding site comparison.

    Science.gov (United States)

    Hung, Che-Lun; Hua, Guan-Jie

    2013-01-01

    The proteome-wide analysis of protein-ligand binding sites and their interactions with ligands is important in structure-based drug design and in understanding ligand cross reactivity and toxicity. The well-known and commonly used software, SMAP, has been designed for 3D ligand binding site comparison and similarity searching of a structural proteome. SMAP can also predict drug side effects and reassign existing drugs to new indications. However, the computing scale of SMAP is limited. We have developed a high availability, high performance system that expands the comparison scale of SMAP. This cloud computing service, called Cloud-PLBS, combines the SMAP and Hadoop frameworks and is deployed on a virtual cloud computing platform. To handle the vast amount of experimental data on protein-ligand binding site pairs, Cloud-PLBS exploits the MapReduce paradigm as a management and parallelizing tool. Cloud-PLBS provides a web portal and scalability through which biologists can address a wide range of computer-intensive questions in biology and drug discovery.

  11. Statistical Estimation of the Protein-Ligand Binding Free Energy Based On Direct Protein-Ligand Interaction Obtained by Molecular Dynamics Simulation

    Directory of Open Access Journals (Sweden)

    Haruki Nakamura

    2012-09-01

    Full Text Available We have developed a method for estimating protein-ligand binding free energy (DG based on the direct protein-ligand interaction obtained by a molecular dynamics simulation. Using this method, we estimated the DG value statistically by the average values of the van der Waals and electrostatic interactions between each amino acid of the target protein and the ligand molecule. In addition, we introduced fluctuations in the accessible surface area (ASA and dihedral angles of the protein-ligand complex system as the entropy terms of the DG estimation. The present method included the fluctuation term of structural change of the protein and the effective dielectric constant. We applied this method to 34 protein-ligand complex structures. As a result, the correlation coefficient between the experimental and calculated DG values was 0.81, and the average error of DG was 1.2 kcal/mol with the use of the fixed parameters. These results were obtained from a 2 nsec molecular dynamics simulation.

  12. Calculation of protein-ligand binding affinities.

    Science.gov (United States)

    Gilson, Michael K; Zhou, Huan-Xiang

    2007-01-01

    Accurate methods of computing the affinity of a small molecule with a protein are needed to speed the discovery of new medications and biological probes. This paper reviews physics-based models of binding, beginning with a summary of the changes in potential energy, solvation energy, and configurational entropy that influence affinity, and a theoretical overview to frame the discussion of specific computational approaches. Important advances are reported in modeling protein-ligand energetics, such as the incorporation of electronic polarization and the use of quantum mechanical methods. Recent calculations suggest that changes in configurational entropy strongly oppose binding and must be included if accurate affinities are to be obtained. The linear interaction energy (LIE) and molecular mechanics Poisson-Boltzmann surface area (MM-PBSA) methods are analyzed, as are free energy pathway methods, which show promise and may be ready for more extensive testing. Ultimately, major improvements in modeling accuracy will likely require advances on multiple fronts, as well as continued validation against experiment.

  13. Models of protein-ligand crystal structures: trust, but verify.

    Science.gov (United States)

    Deller, Marc C; Rupp, Bernhard

    2015-09-01

    X-ray crystallography provides the most accurate models of protein-ligand structures. These models serve as the foundation of many computational methods including structure prediction, molecular modelling, and structure-based drug design. The success of these computational methods ultimately depends on the quality of the underlying protein-ligand models. X-ray crystallography offers the unparalleled advantage of a clear mathematical formalism relating the experimental data to the protein-ligand model. In the case of X-ray crystallography, the primary experimental evidence is the electron density of the molecules forming the crystal. The first step in the generation of an accurate and precise crystallographic model is the interpretation of the electron density of the crystal, typically carried out by construction of an atomic model. The atomic model must then be validated for fit to the experimental electron density and also for agreement with prior expectations of stereochemistry. Stringent validation of protein-ligand models has become possible as a result of the mandatory deposition of primary diffraction data, and many computational tools are now available to aid in the validation process. Validation of protein-ligand complexes has revealed some instances of overenthusiastic interpretation of ligand density. Fundamental concepts and metrics of protein-ligand quality validation are discussed and we highlight software tools to assist in this process. It is essential that end users select high quality protein-ligand models for their computational and biological studies, and we provide an overview of how this can be achieved.

  14. Interaction Entropy: A New Paradigm for Highly Efficient and Reliable Computation of Protein-Ligand Binding Free Energy.

    Science.gov (United States)

    Duan, Lili; Liu, Xiao; Zhang, John Z H

    2016-05-04

    Efficient and reliable calculation of protein-ligand binding free energy is a grand challenge in computational biology and is of critical importance in drug design and many other molecular recognition problems. The main challenge lies in the calculation of entropic contribution to protein-ligand binding or interaction systems. In this report, we present a new interaction entropy method which is theoretically rigorous, computationally efficient, and numerically reliable for calculating entropic contribution to free energy in protein-ligand binding and other interaction processes. Drastically different from the widely employed but extremely expensive normal mode method for calculating entropy change in protein-ligand binding, the new method calculates the entropic component (interaction entropy or -TΔS) of the binding free energy directly from molecular dynamics simulation without any extra computational cost. Extensive study of over a dozen randomly selected protein-ligand binding systems demonstrated that this interaction entropy method is both computationally efficient and numerically reliable and is vastly superior to the standard normal mode approach. This interaction entropy paradigm introduces a novel and intuitive conceptual understanding of the entropic effect in protein-ligand binding and other general interaction systems as well as a practical method for highly efficient calculation of this effect.

  15. Force spectroscopy studies on protein-ligand interactions: a single protein mechanics perspective.

    Science.gov (United States)

    Hu, Xiaotang; Li, Hongbin

    2014-10-01

    Protein-ligand interactions are ubiquitous and play important roles in almost every biological process. The direct elucidation of the thermodynamic, structural and functional consequences of protein-ligand interactions is thus of critical importance to decipher the mechanism underlying these biological processes. A toolbox containing a variety of powerful techniques has been developed to quantitatively study protein-ligand interactions in vitro as well as in living systems. The development of atomic force microscopy-based single molecule force spectroscopy techniques has expanded this toolbox and made it possible to directly probe the mechanical consequence of ligand binding on proteins. Many recent experiments have revealed how ligand binding affects the mechanical stability and mechanical unfolding dynamics of proteins, and provided mechanistic understanding on these effects. The enhancement effect of mechanical stability by ligand binding has been used to help tune the mechanical stability of proteins in a rational manner and develop novel functional binding assays for protein-ligand interactions. Single molecule force spectroscopy studies have started to shed new lights on the structural and functional consequence of ligand binding on proteins that bear force under their biological settings. Copyright © 2014 Federation of European Biochemical Societies. Published by Elsevier B.V. All rights reserved.

  16. Automatic generation of bioinformatics tools for predicting protein-ligand binding sites.

    Science.gov (United States)

    Komiyama, Yusuke; Banno, Masaki; Ueki, Kokoro; Saad, Gul; Shimizu, Kentaro

    2016-03-15

    Predictive tools that model protein-ligand binding on demand are needed to promote ligand research in an innovative drug-design environment. However, it takes considerable time and effort to develop predictive tools that can be applied to individual ligands. An automated production pipeline that can rapidly and efficiently develop user-friendly protein-ligand binding predictive tools would be useful. We developed a system for automatically generating protein-ligand binding predictions. Implementation of this system in a pipeline of Semantic Web technique-based web tools will allow users to specify a ligand and receive the tool within 0.5-1 day. We demonstrated high prediction accuracy for three machine learning algorithms and eight ligands. The source code and web application are freely available for download at http://utprot.net They are implemented in Python and supported on Linux. shimizu@bi.a.u-tokyo.ac.jp Supplementary data are available at Bioinformatics online. © The Author 2015. Published by Oxford University Press.

  17. New type fuel exchange system

    International Nuclear Information System (INIS)

    Meshii, Toshio; Maita, Yasushi; Hirota, Koichi; Kamishima, Yoshio.

    1988-01-01

    When the reduction of the construction cost of FBRs is considered from the standpoint of the machinery and equipment, to make the size small and to heighten the efficiency are the assigned mission. In order to make a reactor vessel small, it is indispensable to decrease the size of the equipment for fuel exchange installed on the upper part of a core. Mitsubishi Heavy Industries Ltd. carried out the research on the development of a new type fuel exchange system. As for the fuel exchange system for FBRs, it is necessary to change the mode of fuel exchange from that of LWRs, such as handling in the presence of chemically active sodium and inert argon atmosphere covering it and handling under heavy shielding against high radiation. The fuel exchange system for FBRs is composed of a fuel exchanger which inserts, pulls out and transfers fuel and rotary plugs. The mechanism adopted for the new type fuel exchange system that Mitsubishi is developing is explained. The feasibility of the mechanism on the upper part of a core was investigated by water flow test, vibration test and buckling test. The design of the mechanism on the upper part of the core of a demonstration FBR was examined, and the new type fuel exchange system was sufficiently applicable. (Kako, I.)

  18. Increased precision for analysis of protein-ligand dissociation constants determined from chemical shift titrations

    Energy Technology Data Exchange (ETDEWEB)

    Markin, Craig J.; Spyracopoulos, Leo, E-mail: leo.spyracopoulos@ualberta.ca [University of Alberta, Department of Biochemistry (Canada)

    2012-06-15

    NMR is ideally suited for the analysis of protein-protein and protein ligand interactions with dissociation constants ranging from {approx}2 {mu}M to {approx}1 mM, and with kinetics in the fast exchange regime on the NMR timescale. For the determination of dissociation constants (K{sub D}) of 1:1 protein-protein or protein-ligand interactions using NMR, the protein and ligand concentrations must necessarily be similar in magnitude to the K{sub D}, and nonlinear least squares analysis of chemical shift changes as a function of ligand concentration is employed to determine estimates for the parameters K{sub D} and the maximum chemical shift change ({Delta}{delta}{sub max}). During a typical NMR titration, the initial protein concentration, [P{sub 0}], is held nearly constant. For this condition, to determine the most accurate parameters for K{sub D} and {Delta}{delta}{sub max} from nonlinear least squares analyses requires initial protein concentrations that are {approx}0.5 Multiplication-Sign K{sub D}, and a maximum concentration for the ligand, or titrant, of {approx}10 Multiplication-Sign [P{sub 0}]. From a practical standpoint, these requirements are often difficult to achieve. Using Monte Carlo simulations, we demonstrate that co-variation of the ligand and protein concentrations during a titration leads to an increase in the precision of the fitted K{sub D} and {Delta}{delta}{sub max} values when [P{sub 0}] > K{sub D}. Importantly, judicious choice of protein and ligand concentrations for a given NMR titration, combined with nonlinear least squares analyses using two independent variables (ligand and protein concentrations) and two parameters (K{sub D} and {Delta}{delta}{sub max}) is a straightforward approach to increasing the accuracy of measured dissociation constants for 1:1 protein-ligand interactions.

  19. Accuracy and precision of protein-ligand interaction kinetics determined from chemical shift titrations

    Energy Technology Data Exchange (ETDEWEB)

    Markin, Craig J.; Spyracopoulos, Leo, E-mail: leo.spyracopoulos@ualberta.ca [University of Alberta, Department of Biochemistry (Canada)

    2012-12-15

    NMR-monitored chemical shift titrations for the study of weak protein-ligand interactions represent a rich source of information regarding thermodynamic parameters such as dissociation constants (K{sub D}) in the micro- to millimolar range, populations for the free and ligand-bound states, and the kinetics of interconversion between states, which are typically within the fast exchange regime on the NMR timescale. We recently developed two chemical shift titration methods wherein co-variation of the total protein and ligand concentrations gives increased precision for the K{sub D} value of a 1:1 protein-ligand interaction (Markin and Spyracopoulos in J Biomol NMR 53: 125-138, 2012). In this study, we demonstrate that classical line shape analysis applied to a single set of {sup 1}H-{sup 15}N 2D HSQC NMR spectra acquired using precise protein-ligand chemical shift titration methods we developed, produces accurate and precise kinetic parameters such as the off-rate (k{sub off}). For experimentally determined kinetics in the fast exchange regime on the NMR timescale, k{sub off} {approx} 3,000 s{sup -1} in this work, the accuracy of classical line shape analysis was determined to be better than 5 % by conducting quantum mechanical NMR simulations of the chemical shift titration methods with the magnetic resonance toolkit GAMMA. Using Monte Carlo simulations, the experimental precision for k{sub off} from line shape analysis of NMR spectra was determined to be 13 %, in agreement with the theoretical precision of 12 % from line shape analysis of the GAMMA simulations in the presence of noise and protein concentration errors. In addition, GAMMA simulations were employed to demonstrate that line shape analysis has the potential to provide reasonably accurate and precise k{sub off} values over a wide range, from 100 to 15,000 s{sup -1}. The validity of line shape analysis for k{sub off} values approaching intermediate exchange ({approx}100 s{sup -1}), may be facilitated by

  20. Accuracy and precision of protein-ligand interaction kinetics determined from chemical shift titrations.

    Science.gov (United States)

    Markin, Craig J; Spyracopoulos, Leo

    2012-12-01

    NMR-monitored chemical shift titrations for the study of weak protein-ligand interactions represent a rich source of information regarding thermodynamic parameters such as dissociation constants (K ( D )) in the micro- to millimolar range, populations for the free and ligand-bound states, and the kinetics of interconversion between states, which are typically within the fast exchange regime on the NMR timescale. We recently developed two chemical shift titration methods wherein co-variation of the total protein and ligand concentrations gives increased precision for the K ( D ) value of a 1:1 protein-ligand interaction (Markin and Spyracopoulos in J Biomol NMR 53: 125-138, 2012). In this study, we demonstrate that classical line shape analysis applied to a single set of (1)H-(15)N 2D HSQC NMR spectra acquired using precise protein-ligand chemical shift titration methods we developed, produces accurate and precise kinetic parameters such as the off-rate (k ( off )). For experimentally determined kinetics in the fast exchange regime on the NMR timescale, k ( off ) ~ 3,000 s(-1) in this work, the accuracy of classical line shape analysis was determined to be better than 5 % by conducting quantum mechanical NMR simulations of the chemical shift titration methods with the magnetic resonance toolkit GAMMA. Using Monte Carlo simulations, the experimental precision for k ( off ) from line shape analysis of NMR spectra was determined to be 13 %, in agreement with the theoretical precision of 12 % from line shape analysis of the GAMMA simulations in the presence of noise and protein concentration errors. In addition, GAMMA simulations were employed to demonstrate that line shape analysis has the potential to provide reasonably accurate and precise k ( off ) values over a wide range, from 100 to 15,000 s(-1). The validity of line shape analysis for k ( off ) values approaching intermediate exchange (~100 s(-1)), may be facilitated by more accurate K ( D ) measurements

  1. The Picture Exchange Communication System.

    Science.gov (United States)

    Bondy, A; Frost, L

    2001-10-01

    The Picture Exchange Communication System (PECS) is an alternative/augmentative communication system that was developed to teach functional communication to children with limited speech. The approach is unique in that it teaches children to initiate communicative interactions within a social framework. This article describes the advantages to implementing PECS over traditional approaches. The PECS training protocol is described wherein children are taught to exchange a single picture for a desired item and eventually to construct picture-based sentences and use a variety of attributes in their requests. The relationship of PECS's implementation to the development of speech in previously nonvocal students is reviewed.

  2. Protein-Ligand Empirical Interaction Components for Virtual Screening.

    Science.gov (United States)

    Yan, Yuna; Wang, Weijun; Sun, Zhaoxi; Zhang, John Z H; Ji, Changge

    2017-08-28

    A major shortcoming of empirical scoring functions is that they often fail to predict binding affinity properly. Removing false positives of docking results is one of the most challenging works in structure-based virtual screening. Postdocking filters, making use of all kinds of experimental structure and activity information, may help in solving the issue. We describe a new method based on detailed protein-ligand interaction decomposition and machine learning. Protein-ligand empirical interaction components (PLEIC) are used as descriptors for support vector machine learning to develop a classification model (PLEIC-SVM) to discriminate false positives from true positives. Experimentally derived activity information is used for model training. An extensive benchmark study on 36 diverse data sets from the DUD-E database has been performed to evaluate the performance of the new method. The results show that the new method performs much better than standard empirical scoring functions in structure-based virtual screening. The trained PLEIC-SVM model is able to capture important interaction patterns between ligand and protein residues for one specific target, which is helpful in discarding false positives in postdocking filtering.

  3. Dual temperature isotope exchange system

    International Nuclear Information System (INIS)

    Spevack, J.S.

    1976-01-01

    Improvements in the method for isotope concentration by dual temperature exchange between feed and auxiliary fluids in a multistage system are described. In a preferred embodiment the first is a vaporizable liquid and the auxiliary fluid a gas, comprising steps for improving the heating and/or cooling and/or humidifying and/or dehumidifying operations

  4. H- charge exchange injection systems

    International Nuclear Information System (INIS)

    Ankenbrandt, C.; Curtis, C.; Hojvat, C.; Johnson, R.P.; Owen, C.; Schmidt, C.; Teng, L.; Webber, R.C.

    1980-01-01

    The techniques and components required for injection of protons into cyclic accelerators by means of H - charge exchange processes are reviewed, with emphasis on the experience at Fermilab. The advantages of the technique are described. The design and performance of the system of injection of H - ions into the Fermilab Booster are detailed. (Auth.)

  5. Recent Progress in Treating Protein-Ligand Interactions with Quantum-Mechanical Methods.

    Science.gov (United States)

    Yilmazer, Nusret Duygu; Korth, Martin

    2016-05-16

    We review the first successes and failures of a "new wave" of quantum chemistry-based approaches to the treatment of protein/ligand interactions. These approaches share the use of "enhanced", dispersion (D), and/or hydrogen-bond (H) corrected density functional theory (DFT) or semi-empirical quantum mechanical (SQM) methods, in combination with ensemble weighting techniques of some form to capture entropic effects. Benchmark and model system calculations in comparison to high-level theoretical as well as experimental references have shown that both DFT-D (dispersion-corrected density functional theory) and SQM-DH (dispersion and hydrogen bond-corrected semi-empirical quantum mechanical) perform much more accurately than older DFT and SQM approaches and also standard docking methods. In addition, DFT-D might soon become and SQM-DH already is fast enough to compute a large number of binding modes of comparably large protein/ligand complexes, thus allowing for a more accurate assessment of entropic effects.

  6. Data Exchange Inventory System (DEXI)

    Data.gov (United States)

    Social Security Administration — Enterprise tool used to identify data exchanges occurring between SSA and our trading partners. DEXI contains information on both incoming and outgoing exchanges and...

  7. EPR of exchange coupled systems

    CERN Document Server

    Bencini, Alessandro

    2012-01-01

    From chemistry to solid state physics to biology, the applications of Electron Paramagnetic Resonance (EPR) are relevant to many areas. This unified treatment is based on the spin Hamiltonian approach and makes extensive use of irreducible tensor techniques to analyze systems in which two or more spins are magnetically coupled. This edition contains a new Introduction by coauthor Dante Gatteschi, a pioneer and scholar of molecular magnetism.The first two chapters review the foundations of exchange interactions, followed by examinations of the spectra of pairs and clusters, relaxation in oligon

  8. Heat exchanges in coarsening systems

    Energy Technology Data Exchange (ETDEWEB)

    Corberi, Federico [Dipartimento di Fisica ' E R Caianiello' , Università di Salerno, via Ponte don Melillo, 84084 Fisciano (Italy); Gonnella, Giuseppe; Piscitelli, Antonio [Dipartimento di Fisica, Università di Bari and Istituto Nazionale di Fisica Nucleare, Sezione di Bari, via Amendola 173, 70126 Bari (Italy)

    2011-10-15

    This paper is a contribution to the understanding of the thermal properties of ageing systems where statistically independent degrees of freedom with greatly separated time scales are expected to coexist. Focusing on the prototypical case of quenched ferromagnets, where fast and slow modes can be respectively associated with fluctuations in the bulk of the coarsening domains and in their interfaces, we perform a set of numerical experiments specifically designed to compute the heat exchanges between different degrees of freedom. Our studies promote a scenario with fast modes acting as an equilibrium reservoir to which interfaces may release heat through a mechanism that allows fast and slow degrees to maintain their statistical properties independently.

  9. Effect of urea on protein-ligand association.

    Science.gov (United States)

    Stepanian, Lora; Son, Ikbae; Chalikian, Tigran V

    2017-12-01

    We combine experimental and theoretical approaches to investigate the influence of a cosolvent on a ligand-protein association event. We apply fluorescence measurements to determining the affinity of the inhibitor tri-N-acetylglucosamine [(GlcNAc) 3 ] for lysozyme at urea concentrations ranging from 0 to 8M. Notwithstanding that, at room temperature and neutral pH, lysozyme retains its native conformation up to the solubility limit of urea, the affinity of (GlcNAc) 3 for the protein steadily decreases as the concentration of urea increases. We analyze the urea dependence of the binding free energy within the framework of a simplified statistical thermodynamics-based model that accounts for the excluded volume effect and direct solute-solvent interactions. The analysis reveals that the detrimental action of urea on the inhibitor-lysozyme binding originates from competition between the free energy contributions of the excluded volume effect and direct solute-solvent interactions. The free energy contribution of direct urea-solute interactions narrowly overcomes the excluded volume contribution thereby resulting in urea weakening the protein-ligand association. More broadly, the successful application of the simple model employed in this work points to the possibility of its use in quantifying the stabilizing/destabilizing action of individual cosolvents on biochemical folding and binding reactions. Copyright © 2016 Elsevier B.V. All rights reserved.

  10. Nanoparticle-Based Receptors Mimic Protein-Ligand Recognition.

    Science.gov (United States)

    Riccardi, Laura; Gabrielli, Luca; Sun, Xiaohuan; De Biasi, Federico; Rastrelli, Federico; Mancin, Fabrizio; De Vivo, Marco

    2017-07-13

    The self-assembly of a monolayer of ligands on the surface of noble-metal nanoparticles dictates the fundamental nanoparticle's behavior and its functionality. In this combined computational-experimental study, we analyze the structure, organization, and dynamics of functionalized coating thiols in monolayer-protected gold nanoparticles (AuNPs). We explain how functionalized coating thiols self-organize through a delicate and somehow counterintuitive balance of interactions within the monolayer itself and with the solvent. We further describe how the nature and plasticity of these interactions modulate nanoparticle-based chemosensing. Importantly, we found that self-organization of coating thiols can induce the formation of binding pockets in AuNPs. These transient cavities can accommodate small molecules, mimicking protein-ligand recognition, which could explain the selectivity and sensitivity observed for different organic analytes in NMR chemosensing experiments. Thus, our findings advocate for the rational design of tailored coating groups to form specific recognition binding sites on monolayer-protected AuNPs.

  11. Data Exchange Inventory (DEXI) System

    Data.gov (United States)

    Social Security Administration — DEXI is an intranet application used by SSA users to track all incoming and outgoing data exchanges between SSA and our data exchange partners. Information such as...

  12. A web server for analysis, comparison and prediction of protein ligand binding sites.

    Science.gov (United States)

    Singh, Harinder; Srivastava, Hemant Kumar; Raghava, Gajendra P S

    2016-03-25

    One of the major challenges in the field of system biology is to understand the interaction between a wide range of proteins and ligands. In the past, methods have been developed for predicting binding sites in a protein for a limited number of ligands. In order to address this problem, we developed a web server named 'LPIcom' to facilitate users in understanding protein-ligand interaction. Analysis, comparison and prediction modules are available in the "LPIcom' server to predict protein-ligand interacting residues for 824 ligands. Each ligand must have at least 30 protein binding sites in PDB. Analysis module of the server can identify residues preferred in interaction and binding motif for a given ligand; for example residues glycine, lysine and arginine are preferred in ATP binding sites. Comparison module of the server allows comparing protein-binding sites of multiple ligands to understand the similarity between ligands based on their binding site. This module indicates that ATP, ADP and GTP ligands are in the same cluster and thus their binding sites or interacting residues exhibit a high level of similarity. Propensity-based prediction module has been developed for predicting ligand-interacting residues in a protein for more than 800 ligands. In addition, a number of web-based tools have been integrated to facilitate users in creating web logo and two-sample between ligand interacting and non-interacting residues. In summary, this manuscript presents a web-server for analysis of ligand interacting residue. This server is available for public use from URL http://crdd.osdd.net/raghava/lpicom .

  13. [Phylogeny of gas exchange systems].

    Science.gov (United States)

    Jürgens, K D; Gros, G

    2002-04-01

    Several systems of gas transport have developed during evolution, all of which are able to sufficiently supply oxygen to the tissues and eliminate the CO2 produced by the metabolism, in spite of great distances between the environment and the individual cells of the tissues. Almost all these systems utilize a combination of convection and diffusion steps. Convection achieves an efficient transport of gas over large distances, but requires energy and cannot occur across tissue barriers. Diffusion, on the other hand, achieves gas transport across barriers, but requires optimization of diffusion paths and diffusion areas. When two convectional gas flows are linked via a diffusional barrier (gas/fluid in the case of the avian lung, fluid/fluid in the case of gills), the directions in which the respective convectional movements pass each other are important determinants of gas exchange efficiency (concurrent, countercurrent and cross-current systems). The tracheal respiration found in insects has the advantage of circumventing the convective gas transport step in the blood, thereby avoiding the high energy expenditure of circulatory systems. This is made possible by a system of tracheae, ending in tracheoles, that reaches from the body surface to every cell within the body. The last step of gas transfer in these animals occurs by diffusion from the tracheoles ("air capillaries") to the mitochondria of cells. The disadvantage is that the tracheal system occupies a substantial fraction of body volume and that, due to limited mechanical stability of tracheal walls, this system would not be able to operate under conditions of high hydrostatic pressures, i. e. in large animals. Respiration in an "open" system, i. e. direct exposure of the diffusional barrier to the environmental air, eliminates the problem of bringing the oxygen to the barrier by convection, as is necessary in the avian and mammalian lung, in the insects' tracheal system and in the gills. An open system is

  14. AMMOS2: a web server for protein-ligand-water complexes refinement via molecular mechanics.

    Science.gov (United States)

    Labbé, Céline M; Pencheva, Tania; Jereva, Dessislava; Desvillechabrol, Dimitri; Becot, Jérôme; Villoutreix, Bruno O; Pajeva, Ilza; Miteva, Maria A

    2017-07-03

    AMMOS2 is an interactive web server for efficient computational refinement of protein-small organic molecule complexes. The AMMOS2 protocol employs atomic-level energy minimization of a large number of experimental or modeled protein-ligand complexes. The web server is based on the previously developed standalone software AMMOS (Automatic Molecular Mechanics Optimization for in silico Screening). AMMOS utilizes the physics-based force field AMMP sp4 and performs optimization of protein-ligand interactions at five levels of flexibility of the protein receptor. The new version 2 of AMMOS implemented in the AMMOS2 web server allows the users to include explicit water molecules and individual metal ions in the protein-ligand complexes during minimization. The web server provides comprehensive analysis of computed energies and interactive visualization of refined protein-ligand complexes. The ligands are ranked by the minimized binding energies allowing the users to perform additional analysis for drug discovery or chemical biology projects. The web server has been extensively tested on 21 diverse protein-ligand complexes. AMMOS2 minimization shows consistent improvement over the initial complex structures in terms of minimized protein-ligand binding energies and water positions optimization. The AMMOS2 web server is freely available without any registration requirement at the URL: http://drugmod.rpbs.univ-paris-diderot.fr/ammosHome.php. © The Author(s) 2017. Published by Oxford University Press on behalf of Nucleic Acids Research.

  15. Model Adoption Exchange Payment System: Executive Summary.

    Science.gov (United States)

    Ambrosino, Robert J.

    This executive summary provides a brief description of the Model Adoption Exchange Payment System (MAEPS), a unique payment system aimed at improving the delivery of adoption exchange services throughout the United States. Following a brief introductory overview, MAEPS is described in terms of (1) its six components (registration, listing,…

  16. Apparent exchange rate imaging in anisotropic systems

    DEFF Research Database (Denmark)

    Sønderby, Casper Kaae; Lundell, Henrik M; Søgaard, Lise V

    2014-01-01

    Double-wave diffusion experiments offer the possibility of probing correlation between molecular diffusion at multiple time points. It has recently been shown that this technique is capable of measuring the exchange of water across cellular membranes. The aim of this study was to investigate...... the effect of macroscopic tissue anisotropy on the measurement of the apparent exchange rate (AXR) in multicompartment systems....

  17. Respiratory system. Part 2: Gaseous exchange.

    Science.gov (United States)

    McLafferty, Ella; Johnstone, Carolyn; Hendry, Charles; Farley, Alistair

    This article, which isthe last in the life sciences series and the second of two articles on the respiratory system, describes gaseous exchange in the lungs, transport of oxygen and carbon dioxide, and internal and external respiration. The article concludes with a brief consideration of two conditions that affect gas exchange and transport: carbon monoxide poisoning and chronic obstructive pulmonary disease.

  18. Quantitative chemogenomics: machine-learning models of protein-ligand interaction.

    Science.gov (United States)

    Andersson, Claes R; Gustafsson, Mats G; Strömbergsson, Helena

    2011-01-01

    Chemogenomics is an emerging interdisciplinary field that lies in the interface of biology, chemistry, and informatics. Most of the currently used drugs are small molecules that interact with proteins. Understanding protein-ligand interaction is therefore central to drug discovery and design. In the subfield of chemogenomics known as proteochemometrics, protein-ligand-interaction models are induced from data matrices that consist of both protein and ligand information along with some experimentally measured variable. The two general aims of this quantitative multi-structure-property-relationship modeling (QMSPR) approach are to exploit sparse/incomplete information sources and to obtain more general models covering larger parts of the protein-ligand space, than traditional approaches that focuses mainly on specific targets or ligands. The data matrices, usually obtained from multiple sparse/incomplete sources, typically contain series of proteins and ligands together with quantitative information about their interactions. A useful model should ideally be easy to interpret and generalize well to new unseen protein-ligand combinations. Resolving this requires sophisticated machine-learning methods for model induction, combined with adequate validation. This review is intended to provide a guide to methods and data sources suitable for this kind of protein-ligand-interaction modeling. An overview of the modeling process is presented including data collection, protein and ligand descriptor computation, data preprocessing, machine-learning-model induction and validation. Concerns and issues specific for each step in this kind of data-driven modeling will be discussed. © 2011 Bentham Science Publishers

  19. Assessment, Cleanup and Redevelopment Exchange System (ACRES)

    Data.gov (United States)

    U.S. Environmental Protection Agency — The Assessment, Cleanup and Redevelopment Exchange System (ACRES) is an online database for Brownfields Grantees to electronically submit data directly to EPA.

  20. Empirical scoring functions for advanced protein-ligand docking with PLANTS.

    Science.gov (United States)

    Korb, Oliver; Stützle, Thomas; Exner, Thomas E

    2009-01-01

    In this paper we present two empirical scoring functions, PLANTS(CHEMPLP) and PLANTS(PLP), designed for our docking algorithm PLANTS (Protein-Ligand ANT System), which is based on ant colony optimization (ACO). They are related, regarding their functional form, to parts of already published scoring functions and force fields. The parametrization procedure described here was able to identify several parameter settings showing an excellent performance for the task of pose prediction on two test sets comprising 298 complexes in total. Up to 87% of the complexes of the Astex diverse set and 77% of the CCDC/Astex clean listnc (noncovalently bound complexes of the clean list) could be reproduced with root-mean-square deviations of less than 2 A with respect to the experimentally determined structures. A comparison with the state-of-the-art docking tool GOLD clearly shows that this is, especially for the druglike Astex diverse set, an improvement in pose prediction performance. Additionally, optimized parameter settings for the search algorithm were identified, which can be used to balance pose prediction reliability and search speed.

  1. The dry heat exchanger calorimeter system

    International Nuclear Information System (INIS)

    Renz, D.P.; Wetzel, J.R.; James, S.J.; Kasperski, P.W.; Duff, M.F.

    1991-01-01

    A radiometric isothermal heat flow calorimeter and preconditioner system that uses air instead of water as the heat exchange medium has been developed at Mound. The dry heat exchanger calorimeter is 42 inches high by 18 inches in diameter and the preconditioner is a 22 inch cube, making it extremely compact compared to existing units. The new system is ideally suited for transportable, stand-alone, or glovebox applications. Preliminary tests of the system have produced sample measurements with standard deviations less than 0.25% and sample errors less than 0.50%. These tests have shown that the dry heat exchanger system will yield acceptance data with an accuracy comparable to those of Mound water bath systems now in use. 4 figs., 1 tab

  2. Physics-based scoring of protein-ligand interactions: explicit polarizability, quantum mechanics and free energies.

    Science.gov (United States)

    Bryce, Richard A

    2011-04-01

    The ability to accurately predict the interaction of a ligand with its receptor is a key limitation in computer-aided drug design approaches such as virtual screening and de novo design. In this article, we examine current strategies for a physics-based approach to scoring of protein-ligand affinity, as well as outlining recent developments in force fields and quantum chemical techniques. We also consider advances in the development and application of simulation-based free energy methods to study protein-ligand interactions. Fuelled by recent advances in computational algorithms and hardware, there is the opportunity for increased integration of physics-based scoring approaches at earlier stages in computationally guided drug discovery. Specifically, we envisage increased use of implicit solvent models and simulation-based scoring methods as tools for computing the affinities of large virtual ligand libraries. Approaches based on end point simulations and reference potentials allow the application of more advanced potential energy functions to prediction of protein-ligand binding affinities. Comprehensive evaluation of polarizable force fields and quantum mechanical (QM)/molecular mechanical and QM methods in scoring of protein-ligand interactions is required, particularly in their ability to address challenging targets such as metalloproteins and other proteins that make highly polar interactions. Finally, we anticipate increasingly quantitative free energy perturbation and thermodynamic integration methods that are practical for optimization of hits obtained from screened ligand libraries.

  3. iview: an interactive WebGL visualizer for protein-ligand complex.

    Science.gov (United States)

    Li, Hongjian; Leung, Kwong-Sak; Nakane, Takanori; Wong, Man-Hon

    2014-02-25

    Visualization of protein-ligand complex plays an important role in elaborating protein-ligand interactions and aiding novel drug design. Most existing web visualizers either rely on slow software rendering, or lack virtual reality support. The vital feature of macromolecular surface construction is also unavailable. We have developed iview, an easy-to-use interactive WebGL visualizer of protein-ligand complex. It exploits hardware acceleration rather than software rendering. It features three special effects in virtual reality settings, namely anaglyph, parallax barrier and oculus rift, resulting in visually appealing identification of intermolecular interactions. It supports four surface representations including Van der Waals surface, solvent excluded surface, solvent accessible surface and molecular surface. Moreover, based on the feature-rich version of iview, we have also developed a neat and tailor-made version specifically for our istar web platform for protein-ligand docking purpose. This demonstrates the excellent portability of iview. Using innovative 3D techniques, we provide a user friendly visualizer that is not intended to compete with professional visualizers, but to enable easy accessibility and platform independence.

  4. Bretton Woods Fixed Exchange Rate System versus Floating Exchange Rate System

    OpenAIRE

    Geza, Paula; Giurca Vasilescu, Laura

    2011-01-01

    One of the most important issues of monetary policy is to find out whether the state should intervene among the exchange rates, taking into account the fact that changes in the exchange rates represent a significant transmission channel of the effects generated by the monetary policy. Taking into consideration the failure of fixed exchange rate regimes and the recent improvement of financial markets, the return in the near future to such a regime – as for example the Bretton Woods system –...

  5. Modem: data exchange among decision support systems

    International Nuclear Information System (INIS)

    Baig, S.; Zaehringer, M.

    2003-01-01

    The aim of the European Research and Development project MODEM (Monitoring Data and Information Exchange Among Decision Support Systems) is to achieve practical improvements for data exchange among decision support systems (DSS). Hence, the results of model calculations become comparable. This is a precondition for harmonised decision making. Based on the analysis of existing procedures, it was decided to use the PUSH-PULL concept. Notifications are actively and automatically sent by the DSS (PUSH). The data can then be downloaded form an in-formation server (PULL). The format of the data is defined in XML (extended markup language). Participants of the project are the DSS: RODOS, ARGOS and RECASS. First, the data is comprised of the source term and meteorological information. Results of the prognoses and measurement data are also to be exchanged. Exercises testing and improving the pro-cedures form an integral part of the project. (orig.)

  6. Computational multiscale modeling in protein--ligand docking.

    Science.gov (United States)

    Taufer, Michela; Armen, Roger; Chen, Jianhan; Teller, Patricia; Brooks, Charles

    2009-01-01

    In biological systems, the binding of small molecule ligands to proteins is a crucial process for almost every aspect of biochemistry and molecular biology. Enzymes are proteins that function by catalyzing specific biochemical reactions that convert reactants into products. Complex organisms are typically composed of cells in which thousands of enzymes participate in complex and interconnected biochemical pathways. Some enzymes serve as sequential steps in specific pathways (such as energy metabolism), while others function to regulate entire pathways and cellular functions [1]. Small molecule ligands can be designed to bind to a specific enzyme and inhibit the biochemical reaction. Inhibiting the activity of key enzymes may result in the entire biochemical pathways being turned on or off [2], [3]. Many small molecule drugs marketed today function in this generic way as enzyme inhibitors. If research identifies a specific enzyme as being crucial to the progress of disease, then this enzyme may be targeted with an inhibitor, which may slow down or reverse the progress of disease. In this way, enzymes are targeted from specific pathogens (e.g., virus, bacteria, fungi) for infectious diseases [4], [5], and human enzymes are targeted for noninfectious diseases such as cardiovascular disease, cancer, diabetes, and neurodegenerative diseases [6].

  7. Computational Approaches to the Chemical Equilibrium Constant in Protein-ligand Binding.

    Science.gov (United States)

    Montalvo-Acosta, Joel José; Cecchini, Marco

    2016-12-01

    The physiological role played by protein-ligand recognition has motivated the development of several computational approaches to the ligand binding affinity. Some of them, termed rigorous, have a strong theoretical foundation but involve too much computation to be generally useful. Some others alleviate the computational burden by introducing strong approximations and/or empirical calibrations, which also limit their general use. Most importantly, there is no straightforward correlation between the predictive power and the level of approximation introduced. Here, we present a general framework for the quantitative interpretation of protein-ligand binding based on statistical mechanics. Within this framework, we re-derive self-consistently the fundamental equations of some popular approaches to the binding constant and pinpoint the inherent approximations. Our analysis represents a first step towards the development of variants with optimum accuracy/efficiency ratio for each stage of the drug discovery pipeline. © 2016 Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim.

  8. Strength and Character of Halogen Bonds in Protein-Ligand Complexes

    Czech Academy of Sciences Publication Activity Database

    Riley, Kevin Eugene; Hobza, Pavel

    2011-01-01

    Roč. 11, č. 10 (2011), s. 4272-4278 ISSN 1528-7483 R&D Projects: GA MŠk LC512 Grant - others:Research and Development for Innovations of European Social Fund(XE) CZ.1.05/2.1.00/03.0058 Institutional research plan: CEZ:AV0Z40550506 Keywords : halogen bond * protein-ligand complexes * calculations Subject RIV: CF - Physical ; Theoretical Chemistry Impact factor: 4.720, year: 2011

  9. Gas exchange measurements in natural systems

    International Nuclear Information System (INIS)

    Broecker, W.S.; Peng, T.H.

    1983-01-01

    Direct knowledge of the rates of gas exchange in lakes and the ocean is based almost entirely on measurements of the isotopes 14 C, 222 Rn and 3 He. The distribution of natural radiocarbon has yielded the average rate of CO 2 exchange for the ocean and for several closed basin lakes. That of bomb produced radiocarbon has been used in the same systems. The 222 Rn to 226 Ra ratio in open ocean surface water has been used to give local short term gas exchange rates. The radon method generally cannot be used in lakes, rivers, estuaries or shelf areas because of the input of radon from sediments. A few attempts have been made to use the excess 3 He produced by decay of bomb produced tritium in lakes to give gas transfer rates. The uncertainty in the molecular diffusivity of helium and in the diffusivity dependence of the rate of gas transfer holds back the application of this method. A few attempts have been made to enrich the surface waters of small lakes with 226 Ra and 3 H in order to allow the use of the 222 Rn and 3 He methods. While these studies give broadly concordant results, many questions remain unanswered. The wind velocity dependence of gas exchange rate has yet to be established in field studies. The dependence of gas exchange rate on molecular diffusivity also remains in limbo. Finally, the degree of enhancement of CO 2 exchange through chemical reactions has been only partially explored. 49 references, 2 figures, 2 tables

  10. Evaluation of Docking Target Functions by the Comprehensive Investigation of Protein-Ligand Energy Minima.

    Science.gov (United States)

    Oferkin, Igor V; Katkova, Ekaterina V; Sulimov, Alexey V; Kutov, Danil C; Sobolev, Sergey I; Voevodin, Vladimir V; Sulimov, Vladimir B

    2015-01-01

    The adequate choice of the docking target function impacts the accuracy of the ligand positioning as well as the accuracy of the protein-ligand binding energy calculation. To evaluate a docking target function we compared positions of its minima with the experimentally known pose of the ligand in the protein active site. We evaluated five docking target functions based on either the MMFF94 force field or the PM7 quantum-chemical method with or without implicit solvent models: PCM, COSMO, and SGB. Each function was tested on the same set of 16 protein-ligand complexes. For exhaustive low-energy minima search the novel MPI parallelized docking program FLM and large supercomputer resources were used. Protein-ligand binding energies calculated using low-energy minima were compared with experimental values. It was demonstrated that the docking target function on the base of the MMFF94 force field in vacuo can be used for discovery of native or near native ligand positions by finding the low-energy local minima spectrum of the target function. The importance of solute-solvent interaction for the correct ligand positioning is demonstrated. It is shown that docking accuracy can be improved by replacement of the MMFF94 force field by the new semiempirical quantum-chemical PM7 method.

  11. Evaluation of Docking Target Functions by the Comprehensive Investigation of Protein-Ligand Energy Minima

    Directory of Open Access Journals (Sweden)

    Igor V. Oferkin

    2015-01-01

    Full Text Available The adequate choice of the docking target function impacts the accuracy of the ligand positioning as well as the accuracy of the protein-ligand binding energy calculation. To evaluate a docking target function we compared positions of its minima with the experimentally known pose of the ligand in the protein active site. We evaluated five docking target functions based on either the MMFF94 force field or the PM7 quantum-chemical method with or without implicit solvent models: PCM, COSMO, and SGB. Each function was tested on the same set of 16 protein-ligand complexes. For exhaustive low-energy minima search the novel MPI parallelized docking program FLM and large supercomputer resources were used. Protein-ligand binding energies calculated using low-energy minima were compared with experimental values. It was demonstrated that the docking target function on the base of the MMFF94 force field in vacuo can be used for discovery of native or near native ligand positions by finding the low-energy local minima spectrum of the target function. The importance of solute-solvent interaction for the correct ligand positioning is demonstrated. It is shown that docking accuracy can be improved by replacement of the MMFF94 force field by the new semiempirical quantum-chemical PM7 method.

  12. GalaxyDock BP2 score: a hybrid scoring function for accurate protein-ligand docking

    Science.gov (United States)

    Baek, Minkyung; Shin, Woong-Hee; Chung, Hwan Won; Seok, Chaok

    2017-07-01

    Protein-ligand docking is a useful tool for providing atomic-level understanding of protein functions in nature and design principles for artificial ligands or proteins with desired properties. The ability to identify the true binding pose of a ligand to a target protein among numerous possible candidate poses is an essential requirement for successful protein-ligand docking. Many previously developed docking scoring functions were trained to reproduce experimental binding affinities and were also used for scoring binding poses. However, in this study, we developed a new docking scoring function, called GalaxyDock BP2 Score, by directly training the scoring power of binding poses. This function is a hybrid of physics-based, empirical, and knowledge-based score terms that are balanced to strengthen the advantages of each component. The performance of the new scoring function exhibits significant improvement over existing scoring functions in decoy pose discrimination tests. In addition, when the score is used with the GalaxyDock2 protein-ligand docking program, it outperformed other state-of-the-art docking programs in docking tests on the Astex diverse set, the Cross2009 benchmark set, and the Astex non-native set. GalaxyDock BP2 Score and GalaxyDock2 with this score are freely available at http://galaxy.seoklab.org/softwares/galaxydock.html.

  13. PSOVina: The hybrid particle swarm optimization algorithm for protein-ligand docking.

    Science.gov (United States)

    Ng, Marcus C K; Fong, Simon; Siu, Shirley W I

    2015-06-01

    Protein-ligand docking is an essential step in modern drug discovery process. The challenge here is to accurately predict and efficiently optimize the position and orientation of ligands in the binding pocket of a target protein. In this paper, we present a new method called PSOVina which combined the particle swarm optimization (PSO) algorithm with the efficient Broyden-Fletcher-Goldfarb-Shannon (BFGS) local search method adopted in AutoDock Vina to tackle the conformational search problem in docking. Using a diverse data set of 201 protein-ligand complexes from the PDBbind database and a full set of ligands and decoys for four representative targets from the directory of useful decoys (DUD) virtual screening data set, we assessed the docking performance of PSOVina in comparison to the original Vina program. Our results showed that PSOVina achieves a remarkable execution time reduction of 51-60% without compromising the prediction accuracies in the docking and virtual screening experiments. This improvement in time efficiency makes PSOVina a better choice of a docking tool in large-scale protein-ligand docking applications. Our work lays the foundation for the future development of swarm-based algorithms in molecular docking programs. PSOVina is freely available to non-commercial users at http://cbbio.cis.umac.mo .

  14. Post hoc support vector machine learning for impedimetric biosensors based on weak protein-ligand interactions.

    Science.gov (United States)

    Rong, Y; Padron, A V; Hagerty, K J; Nelson, N; Chi, S; Keyhani, N O; Katz, J; Datta, S P A; Gomes, C; McLamore, E S

    2018-04-30

    Impedimetric biosensors for measuring small molecules based on weak/transient interactions between bioreceptors and target analytes are a challenge for detection electronics, particularly in field studies or in the analysis of complex matrices. Protein-ligand binding sensors have enormous potential for biosensing, but achieving accuracy in complex solutions is a major challenge. There is a need for simple post hoc analytical tools that are not computationally expensive, yet provide near real time feedback on data derived from impedance spectra. Here, we show the use of a simple, open source support vector machine learning algorithm for analyzing impedimetric data in lieu of using equivalent circuit analysis. We demonstrate two different protein-based biosensors to show that the tool can be used for various applications. We conclude with a mobile phone-based demonstration focused on the measurement of acetone, an important biomarker related to the onset of diabetic ketoacidosis. In all conditions tested, the open source classifier was capable of performing as well as, or better, than the equivalent circuit analysis for characterizing weak/transient interactions between a model ligand (acetone) and a small chemosensory protein derived from the tsetse fly. In addition, the tool has a low computational requirement, facilitating use for mobile acquisition systems such as mobile phones. The protocol is deployed through Jupyter notebook (an open source computing environment available for mobile phone, tablet or computer use) and the code was written in Python. For each of the applications, we provide step-by-step instructions in English, Spanish, Mandarin and Portuguese to facilitate widespread use. All codes were based on scikit-learn, an open source software machine learning library in the Python language, and were processed in Jupyter notebook, an open-source web application for Python. The tool can easily be integrated with the mobile biosensor equipment for rapid

  15. Forging the Basis for Developing Protein-Ligand Interaction Scoring Functions.

    Science.gov (United States)

    Liu, Zhihai; Su, Minyi; Han, Li; Liu, Jie; Yang, Qifan; Li, Yan; Wang, Renxiao

    2017-02-21

    In structure-based drug design, scoring functions are widely used for fast evaluation of protein-ligand interactions. They are often applied in combination with molecular docking and de novo design methods. Since the early 1990s, a whole spectrum of protein-ligand interaction scoring functions have been developed. Regardless of their technical difference, scoring functions all need data sets combining protein-ligand complex structures and binding affinity data for parametrization and validation. However, data sets of this kind used to be rather limited in terms of size and quality. On the other hand, standard metrics for evaluating scoring function used to be ambiguous. Scoring functions are often tested in molecular docking or even virtual screening trials, which do not directly reflect the genuine quality of scoring functions. Collectively, these underlying obstacles have impeded the invention of more advanced scoring functions. In this Account, we describe our long-lasting efforts to overcome these obstacles, which involve two related projects. On the first project, we have created the PDBbind database. It is the first database that systematically annotates the protein-ligand complexes in the Protein Data Bank (PDB) with experimental binding data. This database has been updated annually since its first public release in 2004. The latest release (version 2016) provides binding data for 16 179 biomolecular complexes in PDB. Data sets provided by PDBbind have been applied to many computational and statistical studies on protein-ligand interaction and various subjects. In particular, it has become a major data resource for scoring function development. On the second project, we have established the Comparative Assessment of Scoring Functions (CASF) benchmark for scoring function evaluation. Our key idea is to decouple the "scoring" process from the "sampling" process, so scoring functions can be tested in a relatively pure context to reflect their quality. In our

  16. Fast automated placement of polar hydrogen atoms in protein-ligand complexes

    Directory of Open Access Journals (Sweden)

    Lippert Tobias

    2009-08-01

    Full Text Available Abstract Background Hydrogen bonds play a major role in the stabilization of protein-ligand complexes. The ability of a functional group to form them depends on the position of its hydrogen atoms. An accurate knowledge of the positions of hydrogen atoms in proteins is therefore important to correctly identify hydrogen bonds and their properties. The high mobility of hydrogen atoms introduces several degrees of freedom: Tautomeric states, where a hydrogen atom alters its binding partner, torsional changes where the position of the hydrogen atom is rotated around the last heavy-atom bond in a residue, and protonation states, where the number of hydrogen atoms at a functional group may change. Also, side-chain flips in glutamine and asparagine and histidine residues, which are common crystallographic ambiguities must be identified before structure-based calculations can be conducted. Results We have implemented a method to determine the most probable hydrogen atom positions in a given protein-ligand complex. Optimality of hydrogen bond geometries is determined by an empirical scoring function which is used in molecular docking. This allows to evaluate protein-ligand interactions with an established model. Also, our method allows to resolve common crystallographic ambiguities such as as flipped amide groups and histidine residues. To ensure high speed, we make use of a dynamic programming approach. Conclusion Our results were checked against selected high-resolution structures from an external dataset, for which the positions of the hydrogen atoms have been validated manually. The quality of our results is comparable to that of other programs, with the advantage of being fast enough to be applied on-the-fly for interactive usage or during score evaluation.

  17. Preliminary thermal sizing of intermediate heat exchanger for NHDD system

    International Nuclear Information System (INIS)

    Kim, Chan Soo; Hong, Sung Deok; Kim, Yong Wan; Chang, Jongh Wa

    2009-01-01

    Nuclear Hydrogen Development and Demonstration (NHDD) system is a Very High Temperature gascooled Reactor (VHTR) coupled with hydrogen production systems. Intermediate heat exchanger transfers heat from the nuclear reactor to the hydrogen production system. This study presented the sensitivity analysis on a preliminary thermal sizing of the intermediate heat exchanger. Printed Circuit Heat Exchanger (PCHE) was selected for the thermal sizing because the printed circuit heat exchanger has the largest compactness among the heat exchanger types. The analysis was performed to estimate the effect of key parameters including the operating condition of the intermediate system, the geometrical factors of the PCHE, and the working fluid of the intermediate system.

  18. Study of kinetics, equilibrium and isotope exchange in ion exchange systems Pt. 6

    International Nuclear Information System (INIS)

    Plicka, J.; Stamberg, K.; Cabicar, J.; Gosman, A.

    1986-01-01

    The description of kinetics of ion exchange in ternary system was based upon three Nernst-Planck equations, each of them describing the particle diffusion flux of a given counterion as an independent process. For experimental verification, the strongly acidic cation exchanger OSTION KS 08 the shallow-bed technique, and 0.2 mol x dm -3 aqueous nitrate solutions were chosen. The kinetics of ion exchange in the system of cations Na + - Mg 2+ - UO 2 2+ was studied. The values of diffusion coefficients obtained by evaluating of kinetics of isotope exchange and binary ion exchange were used for calculation. The comparison of calculated exchange rate curves with the experimental ones was made. It was found that the exchanging counterions were affected by each other. (author)

  19. Plasma exchange in progressive systemic sclerosis

    Directory of Open Access Journals (Sweden)

    Mohammad Bagher Owlia

    2015-10-01

    Full Text Available Systemic sclerosis (SSc is an autoimmune systemic disease of unknown etiology. Present treatment modalities have limited impact on clinical/ laboratory outcomes. For the first time in our center, we used plasma exchange (PEx in a rather young woman with recent onset but progressive SSc. She is a 39-year-old woman with a recent history of skin stiffness, Raynaud’s phenomenon, nail fold capillary changes and newly diagnosis of SSc presented to us due to worsening her clinical symptoms even after initiation of routine remedies such as low dose oral prednisolone, Ca-channel blockers, azathioprine and pentoxyfylline. After obtaining written consent, interdisciplinary discussion with experts in this field and agreement we started a series of plasma exchange with FFP replacement for her. A dramatic clinical response was observed in respect to Raynaud’s phenomenon, skin stiffness, tendon rub after three sessions of PEx. Her modified Rodnan skin score (MRSS dropped from 36 (before commencement of therapy to 28 in day 4 and 18 in day 20 after 15 sessions of PEx. In conclusion PEx could significantly modify the course of SSc as observed in our case study. Elimination of culprit immune mediators/cytokines/autoantibodies could be the possible mechanism of action of PEx. 

  20. Automated identification of protein-ligand interaction features using Inductive Logic Programming: a hexose binding case study

    Directory of Open Access Journals (Sweden)

    A Santos Jose C

    2012-07-01

    Full Text Available Abstract Background There is a need for automated methods to learn general features of the interactions of a ligand class with its diverse set of protein receptors. An appropriate machine learning approach is Inductive Logic Programming (ILP, which automatically generates comprehensible rules in addition to prediction. The development of ILP systems which can learn rules of the complexity required for studies on protein structure remains a challenge. In this work we use a new ILP system, ProGolem, and demonstrate its performance on learning features of hexose-protein interactions. Results The rules induced by ProGolem detect interactions mediated by aromatics and by planar-polar residues, in addition to less common features such as the aromatic sandwich. The rules also reveal a previously unreported dependency for residues cys and leu. They also specify interactions involving aromatic and hydrogen bonding residues. This paper shows that Inductive Logic Programming implemented in ProGolem can derive rules giving structural features of protein/ligand interactions. Several of these rules are consistent with descriptions in the literature. Conclusions In addition to confirming literature results, ProGolem’s model has a 10-fold cross-validated predictive accuracy that is superior, at the 95% confidence level, to another ILP system previously used to study protein/hexose interactions and is comparable with state-of-the-art statistical learners.

  1. Automated identification of protein-ligand interaction features using Inductive Logic Programming: a hexose binding case study.

    Science.gov (United States)

    A Santos, Jose C; Nassif, Houssam; Page, David; Muggleton, Stephen H; E Sternberg, Michael J

    2012-07-11

    There is a need for automated methods to learn general features of the interactions of a ligand class with its diverse set of protein receptors. An appropriate machine learning approach is Inductive Logic Programming (ILP), which automatically generates comprehensible rules in addition to prediction. The development of ILP systems which can learn rules of the complexity required for studies on protein structure remains a challenge. In this work we use a new ILP system, ProGolem, and demonstrate its performance on learning features of hexose-protein interactions. The rules induced by ProGolem detect interactions mediated by aromatics and by planar-polar residues, in addition to less common features such as the aromatic sandwich. The rules also reveal a previously unreported dependency for residues cys and leu. They also specify interactions involving aromatic and hydrogen bonding residues. This paper shows that Inductive Logic Programming implemented in ProGolem can derive rules giving structural features of protein/ligand interactions. Several of these rules are consistent with descriptions in the literature. In addition to confirming literature results, ProGolem's model has a 10-fold cross-validated predictive accuracy that is superior, at the 95% confidence level, to another ILP system previously used to study protein/hexose interactions and is comparable with state-of-the-art statistical learners.

  2. Divided-evolution-based pulse scheme for quantifying exchange processes in proteins: powerful complement to relaxation dispersion experiments.

    Science.gov (United States)

    Bouvignies, Guillaume; Hansen, D Flemming; Vallurupalli, Pramodh; Kay, Lewis E

    2011-02-16

    A method for quantifying millisecond time scale exchange in proteins is presented based on scaling the rate of chemical exchange using a 2D (15)N, (1)H(N) experiment in which (15)N dwell times are separated by short spin-echo pulse trains. Unlike the popular Carr-Purcell-Meiboom-Gill (CPMG) experiment where the effects of a radio frequency field on measured transverse relaxation rates are quantified, the new approach measures peak positions in spectra that shift as the effective exchange time regime is varied. The utility of the method is established through an analysis of data recorded on an exchanging protein-ligand system for which the exchange parameters have been accurately determined using alternative approaches. Computations establish that a combined analysis of CPMG and peak shift profiles extends the time scale that can be studied to include exchanging systems with highly skewed populations and exchange rates as slow as 20 s(-1).

  3. Model Adoption Exchange Payment System: Technical Specifications and User Instructions.

    Science.gov (United States)

    Ambrosino, Robert J.

    This user's manual, designed to meet the needs of adoption exchange administrators and program managers for a formal tool to assist them in the overall management and operation of their program, presents the Model Adoption Exchange Payment System (MAEPS), which was developed to improve the delivery of adoption exchange services throughout the…

  4. Orbital Propagation of Momentum Exchange Tether Systems

    Science.gov (United States)

    Westerhoff, John

    2002-01-01

    An advanced concept in in-space transportation currently being studied is the Momentum-Exchange/Electrodynamic Reboost Tether System (MXER). The system acts as a large momentum wheel, imparting a Av to a payload in low earth orbit (LEO) at the expense of its own orbital energy. After throwing a payload, the system reboosts itself using an electrodynamic tether to push against Earth's magnetic field and brings itself back up to an operational orbit to prepare for the next payload. The ability to reboost itself allows for continued reuse of the system without the expenditure of propellants. Considering the cost of lifting propellant from the ,ground to LEO to do the same Av boost at $10000 per pound, the system cuts the launch cost of the payload dramatically, and subsequently, the MXER system pays for itself after a small number of missions.1 One of the technical hurdles to be overcome with the MXER concept is the rendezvous maneuver. The rendezvous window for the capture of the payload is on the order of a few seconds, as opposed to traditional docking maneuvers, which can take as long ets necessary to complete a precise docking. The payload, therefore, must be able to match its orbit to meet up with the capture device on the end of the tether at a specific time and location in the future. In order to be able to determine that location, the MXER system must be numerically propagated forward in time to predict where the capture device will be at that instant. It should be kept in mind that the propagation computation must be done faster than real-time. This study focuses on the efforts to find and/or build the tools necessary to numerically propagate the motion of the MXER system as accurately as possible.

  5. Verification on reliability of heat exchanger for primary cooling system

    International Nuclear Information System (INIS)

    Koike, Sumio; Gorai, Shigeru; Onoue, Ryuji; Ohtsuka, Kaoru

    2010-07-01

    Prior to the JMTR refurbishment, verification on reliability of the heat exchangers for primary cooling system was carried out to investigate an integrity of continuously use component. From a result of the significant corrosion, decrease of tube thickness, crack were not observed on the heat exchangers, and integrity of heat exchangers were confirmed. In the long terms usage of the heat exchangers, the maintenance based on periodical inspection and a long-term maintenance plan is scheduled. (author)

  6. RiverHeath: Neighborhood Loop Geothermal Exchange System

    Energy Technology Data Exchange (ETDEWEB)

    Geall, Mark [RiverHeath LLC, Appleton, WI (United States)

    2016-07-11

    The goal of the RiverHeath project is to develop a geothermal exchange system at lower capital infrastructure cost than current geothermal exchange systems. The RiverHeath system features an innovative design that incorporates use of the adjacent river through river-based heat exchange plates. The flowing water provides a tremendous amount of heat transfer. As a result, the installation cost of this geothermal exchange system is lower than more traditional vertical bore systems. Many urban areas are located along rivers and other waterways. RiverHeath will serve as a template for other projects adjacent to the water.

  7. Descriptor Data Bank (DDB): A Cloud Platform for Multiperspective Modeling of Protein-Ligand Interactions.

    Science.gov (United States)

    Ashtawy, Hossam M; Mahapatra, Nihar R

    2018-01-22

    Protein-ligand (PL) interactions play a key role in many life processes such as molecular recognition, molecular binding, signal transmission, and cell metabolism. Examples of interaction forces include hydrogen bonding, hydrophobic effects, steric clashes, electrostatic contacts, and van der Waals attractions. Currently, a large number of hypotheses and perspectives to model these interaction forces are scattered throughout the literature and largely forgotten. Instead, had they been assembled and utilized collectively, they would have substantially improved the accuracy of predicting binding affinity of protein-ligand complexes. In this work, we present Descriptor Data Bank (DDB), a data-driven platform on the cloud for facilitating multiperspective modeling of PL interactions. DDB is an open-access hub for depositing, hosting, executing, and sharing descriptor extraction tools and data for a large number of interaction modeling hypotheses. The platform also implements a machine-learning (ML) toolbox for automatic descriptor filtering and analysis and scoring function (SF) fitting and prediction. The descriptor filtering module is used to filter out irrelevant and/or noisy descriptors and to produce a compact subset from all available features. We seed DDB with 16 diverse descriptor extraction tools developed in-house and collected from the literature. The tools altogether generate over 2700 descriptors that characterize (i) proteins, (ii) ligands, and (iii) protein-ligand complexes. The in-house descriptors we extract are protein-specific which are based on pairwise primary and tertiary alignment of protein structures followed by clustering and trilateration. We built and used DDB's ML library to fit SFs to the in-house descriptors and those collected from the literature. We then evaluated them on several data sets that were constructed to reflect real-world drug screening scenarios. We found that multiperspective SFs that were constructed using a large number

  8. The XChemExplorer graphical workflow tool for routine or large-scale protein-ligand structure determination.

    Science.gov (United States)

    Krojer, Tobias; Talon, Romain; Pearce, Nicholas; Collins, Patrick; Douangamath, Alice; Brandao-Neto, Jose; Dias, Alexandre; Marsden, Brian; von Delft, Frank

    2017-03-01

    XChemExplorer (XCE) is a data-management and workflow tool to support large-scale simultaneous analysis of protein-ligand complexes during structure-based ligand discovery (SBLD). The user interfaces of established crystallographic software packages such as CCP4 [Winn et al. (2011), Acta Cryst. D67, 235-242] or PHENIX [Adams et al. (2010), Acta Cryst. D66, 213-221] have entrenched the paradigm that a `project' is concerned with solving one structure. This does not hold for SBLD, where many almost identical structures need to be solved and analysed quickly in one batch of work. Functionality to track progress and annotate structures is essential. XCE provides an intuitive graphical user interface which guides the user from data processing, initial map calculation, ligand identification and refinement up until data dissemination. It provides multiple entry points depending on the need of each project, enables batch processing of multiple data sets and records metadata, progress and annotations in an SQLite database. XCE is freely available and works on any Linux and Mac OS X system, and the only dependency is to have the latest version of CCP4 installed. The design and usage of this tool are described here, and its usefulness is demonstrated in the context of fragment-screening campaigns at the Diamond Light Source. It is routinely used to analyse projects comprising 1000 data sets or more, and therefore scales well to even very large ligand-design projects.

  9. Heat exchangers in heavy water reactor systems

    International Nuclear Information System (INIS)

    Mehta, S.K.

    1988-01-01

    Important features of some major heat exchange components of pressurized heavy water reactors and DHRUVA research reactor are presented. Design considerations and nuclear service classifications are discussed

  10. Data Exchange Management Information System (DEMIS)

    Data.gov (United States)

    Social Security Administration — DEMIS combines a database (Operational Data Store - ODS) of data exchange-related Management Information (MI) with the agency's querying and reporting utility, the...

  11. System for enrichment by dual temperature exchange

    International Nuclear Information System (INIS)

    Spevack, J.S.

    1975-01-01

    In dual temperature isotope exchange systems utilizing different fluid substances in liquid and gas phases separable from and soluble in each other (for example H 2 O and H 2 S), the phases are passed countercurrent to each other in towers maintained at relatively hot and cold temperatures. Combinations of method and means are provided by which the gas is raised to hot tower temperature and humidity conditions principally by heat derived from the cooling and dehumidification of the gas leaving the hot tower as it is being reduced in temperature and humidity to cold tower conditions. Special provisions are made in the combinations for transferring this heat and for completing the conditioning of the gas to the respective tower conditions with high efficiency, for economically controlling the temperature of the condensate to adapt it for transfer to different parts of the system, and for economically stripping dissolved gas and heat from the effluent liquid and returning it to the system in manners that aid the thermal conditioning of the main gas stream

  12. Study of kinetics, equilibrium and isotope exchange in ion exchange systems Pt. 4

    International Nuclear Information System (INIS)

    Stamberg, K.; Plicka, J.; Calibar, J.; Gosman, A.

    1985-01-01

    The kinetics of ion exchange in the Nasup(+)-Mgsup(2+)-strongly acidic cation exchanger system in a batch stirred reactor was studied. The samples of exchangers OSTION KS (containing DVB in the range of 1.5 - 12%) and AMBERLITE IR 120 for experimental work were used; the concentration of the aqueous nitrate solution was always 0.2M. The Nernst-Planck equation for description of diffusion of ions in a particle was used. The values of diffusion coefficients of magnesium ions in the exchangers and their dependence on the content of DVB were obtained by evaluating the experimental data and using the self-diffusion coefficients of sodium. (author)

  13. Magnetic stability in exchange-spring and exchange bias systems after multiple switching cycles.

    Energy Technology Data Exchange (ETDEWEB)

    Jiang, J. S.; Inomata, A.; You, C.-Y.; Pearson, J. E.; Bader, S. D.

    2001-06-01

    We have studied the magnetic stability in exchange bias and exchange spring systems prepared via epitaxial sputter deposition. The two interfacial exchange coupled systems, Fe/Cr(211) double superlattices consisting of a ferromagnetic and an antiferromagnetic Fe/Cr superlattice that are exchange coupled through a Cr spacer, and Sin-Co/Fe exchange-spring bilayer structures with ferromagnetically coupled hard Sin-Co layer and soft Fe layer, were epitaxially grown on suitably prepared Cr buffer layers to give rise to different microstructure and magnetic anisotropy. The magnetic stability was investigated using the magneto-optic Kerr effect during repeated reversal of the soft layer magnetization by field cycling up to 10{sup 7} times. For uniaxial Fe/Cr exchange biased double superlattices and exchange spring bilayers with uniaxial Sin-Co, small but rapid initial decay in the exchange bias field HE and in the remanent magnetization is observed. However, the exchange spring bilayers with biaxial and random in-plane anisotropy in the Sin-Co layer shows gradual decay in H{sub E} and without large reduction of the magnetization. The different decay behaviors are attributed to the different microstructure and spin configuration of the pinning layers.

  14. A method for fast energy estimation and visualization of protein-ligand interaction

    Science.gov (United States)

    Tomioka, Nobuo; Itai, Akiko; Iitaka, Yoichi

    1987-10-01

    A new computational and graphical method for facilitating ligand-protein docking studies is developed on a three-dimensional computer graphics display. Various physical and chemical properties inside the ligand binding pocket of a receptor protein, whose structure is elucidated by X-ray crystal analysis, are calculated on three-dimensional grid points and are stored in advance. By utilizing those tabulated data, it is possible to estimate the non-bonded and electrostatic interaction energy and the number of possible hydrogen bonds between protein and ligand molecules in real time during an interactive docking operation. The method also provides a comprehensive visualization of the local environment inside the binding pocket. With this method, it becomes easier to find a roughly stable geometry of ligand molecules, and one can therefore make a rapid survey of the binding capability of many drug candidates. The method will be useful for drug design as well as for the examination of protein-ligand interactions.

  15. Protein-ligand interactions investigated by thermal shift assays (TSA) and dual polarization interferometry (DPI).

    Science.gov (United States)

    Grøftehauge, Morten K; Hajizadeh, Nelly R; Swann, Marcus J; Pohl, Ehmke

    2015-01-01

    Over the last decades, a wide range of biophysical techniques investigating protein-ligand interactions have become indispensable tools to complement high-resolution crystal structure determinations. Current approaches in solution range from high-throughput-capable methods such as thermal shift assays (TSA) to highly accurate techniques including microscale thermophoresis (MST) and isothermal titration calorimetry (ITC) that can provide a full thermodynamic description of binding events. Surface-based methods such as surface plasmon resonance (SPR) and dual polarization interferometry (DPI) allow real-time measurements and can provide kinetic parameters as well as binding constants. DPI provides additional spatial information about the binding event. Here, an account is presented of new developments and recent applications of TSA and DPI connected to crystallography.

  16. Composition of Overlapping Protein-Protein and Protein-Ligand Interfaces.

    Directory of Open Access Journals (Sweden)

    Ruzianisra Mohamed

    Full Text Available Protein-protein interactions (PPIs play a major role in many biological processes and they represent an important class of targets for therapeutic intervention. However, targeting PPIs is challenging because often no convenient natural substrates are available as starting point for small-molecule design. Here, we explored the characteristics of protein interfaces in five non-redundant datasets of 174 protein-protein (PP complexes, and 161 protein-ligand (PL complexes from the ABC database, 436 PP complexes, and 196 PL complexes from the PIBASE database and a dataset of 89 PL complexes from the Timbal database. In all cases, the small molecule ligands must bind at the respective PP interface. We observed similar amino acid frequencies in all three datasets. Remarkably, also the characteristics of PP contacts and overlapping PL contacts are highly similar.

  17. 40 CFR 63.1409 - Heat exchange system provisions.

    Science.gov (United States)

    2010-07-01

    ... detect leaks. (2)(i) For recirculating heat exchange systems (cooling tower systems), the monitoring of...-through heat exchange systems, the monitoring of speciated HAP or total HAP refers to the HAP listed in... operator shall maintain, at all times, the monitoring plan that is currently in use. The current plan shall...

  18. Impact of protein and ligand impurities on ITC-derived protein-ligand thermodynamics.

    Science.gov (United States)

    Grüner, Stefan; Neeb, Manuel; Barandun, Luzi Jakob; Sielaff, Frank; Hohn, Christoph; Kojima, Shun; Steinmetzer, Torsten; Diederich, François; Klebe, Gerhard

    2014-09-01

    The thermodynamic characterization of protein-ligand interactions by isothermal titration calorimetry (ITC) is a powerful tool in drug design, giving valuable insight into the interaction driving forces. ITC is thought to require protein and ligand solutions of high quality, meaning both the absence of contaminants as well as accurately determined concentrations. Ligands synthesized to deviating purity and protein of different pureness were titrated by ITC. Data curation was attempted also considering information from analytical techniques to correct stoichiometry. We used trypsin and tRNA-guanine transglycosylase (TGT), together with high affinity ligands to investigate the effect of errors in protein concentration as well as the impact of ligand impurities on the apparent thermodynamics. We found that errors in protein concentration did not change the thermodynamic properties obtained significantly. However, most ligand impurities led to pronounced changes in binding enthalpy. If protein binding of the respective impurity is not expected, the actual ligand concentration was corrected for and the thus revised data compared to thermodynamic properties obtained with the respective pure ligand. Even in these cases, we observed differences in binding enthalpy of about 4kJ⋅mol(-1), which is considered significant. Our results indicate that ligand purity is the critical parameter to monitor if accurate thermodynamic data of a protein-ligand complex are to be recorded. Furthermore, artificially changing fitting parameters to obtain a sound interaction stoichiometry in the presence of uncharacterized ligand impurities may lead to thermodynamic parameters significantly deviating from the accurate thermodynamic signature. Copyright © 2014 Elsevier B.V. All rights reserved.

  19. The Exchange Value Embedded in a Transport System

    International Nuclear Information System (INIS)

    Xia Qinglan; Xu Shaofeng

    2010-01-01

    This paper shows that a well designed transport system has an embedded exchange value by serving as a market for potential exchange between consumers. Under suitable conditions, one can improve the welfare of consumers in the system simply by allowing some exchange of goods between consumers during transportation without incurring additional transportation cost. We propose an explicit valuation formula to measure this exchange value for a given compatible transport system. This value is always nonnegative and bounded from above. Criteria based on transport structures, preferences and prices are provided to determine the existence of a positive exchange value. Finally, we study a new optimal transport problem with an objective taking into account of both transportation cost and exchange value.

  20. Intelligent transportation system (ITS) international research exchange.

    Science.gov (United States)

    2014-01-01

    ITS applications address surface transportation challenges in safety, mobility, and : sustainability that are similar in cause and impact worldwide. International ITS : exchange allows cooperating nations to benefit from each others pre-competitiv...

  1. istar: a web platform for large-scale protein-ligand docking.

    Directory of Open Access Journals (Sweden)

    Hongjian Li

    Full Text Available Protein-ligand docking is a key computational method in the design of starting points for the drug discovery process. We are motivated by the desire to automate large-scale docking using our popular docking engine idock and thus have developed a publicly-accessible web platform called istar. Without tedious software installation, users can submit jobs using our website. Our istar website supports 1 filtering ligands by desired molecular properties and previewing the number of ligands to dock, 2 monitoring job progress in real time, and 3 visualizing ligand conformations and outputting free energy and ligand efficiency predicted by idock, binding affinity predicted by RF-Score, putative hydrogen bonds, and supplier information for easy purchase, three useful features commonly lacked on other online docking platforms like DOCK Blaster or iScreen. We have collected 17,224,424 ligands from the All Clean subset of the ZINC database, and revamped our docking engine idock to version 2.0, further improving docking speed and accuracy, and integrating RF-Score as an alternative rescoring function. To compare idock 2.0 with the state-of-the-art AutoDock Vina 1.1.2, we have carried out a rescoring benchmark and a redocking benchmark on the 2,897 and 343 protein-ligand complexes of PDBbind v2012 refined set and CSAR NRC HiQ Set 24Sept2010 respectively, and an execution time benchmark on 12 diverse proteins and 3,000 ligands of different molecular weight. Results show that, under various scenarios, idock achieves comparable success rates while outperforming AutoDock Vina in terms of docking speed by at least 8.69 times and at most 37.51 times. When evaluated on the PDBbind v2012 core set, our istar platform combining with RF-Score manages to reproduce Pearson's correlation coefficient and Spearman's correlation coefficient of as high as 0.855 and 0.859 respectively between the experimental binding affinity and the predicted binding affinity of the docked

  2. istar: a web platform for large-scale protein-ligand docking.

    Science.gov (United States)

    Li, Hongjian; Leung, Kwong-Sak; Ballester, Pedro J; Wong, Man-Hon

    2014-01-01

    Protein-ligand docking is a key computational method in the design of starting points for the drug discovery process. We are motivated by the desire to automate large-scale docking using our popular docking engine idock and thus have developed a publicly-accessible web platform called istar. Without tedious software installation, users can submit jobs using our website. Our istar website supports 1) filtering ligands by desired molecular properties and previewing the number of ligands to dock, 2) monitoring job progress in real time, and 3) visualizing ligand conformations and outputting free energy and ligand efficiency predicted by idock, binding affinity predicted by RF-Score, putative hydrogen bonds, and supplier information for easy purchase, three useful features commonly lacked on other online docking platforms like DOCK Blaster or iScreen. We have collected 17,224,424 ligands from the All Clean subset of the ZINC database, and revamped our docking engine idock to version 2.0, further improving docking speed and accuracy, and integrating RF-Score as an alternative rescoring function. To compare idock 2.0 with the state-of-the-art AutoDock Vina 1.1.2, we have carried out a rescoring benchmark and a redocking benchmark on the 2,897 and 343 protein-ligand complexes of PDBbind v2012 refined set and CSAR NRC HiQ Set 24Sept2010 respectively, and an execution time benchmark on 12 diverse proteins and 3,000 ligands of different molecular weight. Results show that, under various scenarios, idock achieves comparable success rates while outperforming AutoDock Vina in terms of docking speed by at least 8.69 times and at most 37.51 times. When evaluated on the PDBbind v2012 core set, our istar platform combining with RF-Score manages to reproduce Pearson's correlation coefficient and Spearman's correlation coefficient of as high as 0.855 and 0.859 respectively between the experimental binding affinity and the predicted binding affinity of the docked conformation. istar

  3. Simple knowledge-based descriptors to predict protein-ligand interactions. Methodology and validation

    Science.gov (United States)

    Nissink, J. Willem M.; Verdonk, Marcel L.; Klebe, Gerhard

    2000-11-01

    A new type of shape descriptor is proposed to describe the spatial orientation for non-covalent interactions. It is built from simple, anisotropic Gaussian contributions that are parameterised by 10 adjustable values. The descriptors have been used to fit propensity distributions derived from scatter data stored in the IsoStar database. This database holds composite pictures of possible interaction geometries between a common central group and various interacting moieties, as extracted from small-molecule crystal structures. These distributions can be related to probabilities for the occurrence of certain interaction geometries among different functional groups. A fitting procedure is described that generates the descriptors in a fully automated way. For this purpose, we apply a similarity index that is tailored to the problem, the Split Hodgkin Index. It accounts for the similarity in regions of either high or low propensity in a separate way. Although dependent on the division into these two subregions, the index is robust and performs better than the regular Hodgkin index. The reliability and coverage of the fitted descriptors was assessed using SuperStar. SuperStar usually operates on the raw IsoStar data to calculate propensity distributions, e.g., for a binding site in a protein. For our purpose we modified the code to have it operate on our descriptors instead. This resulted in a substantial reduction in calculation time (factor of five to eight) compared to the original implementation. A validation procedure was performed on a set of 130 protein-ligand complexes, using four representative interacting probes to map the properties of the various binding sites: ammonium nitrogen, alcohol oxygen, carbonyl oxygen, and methyl carbon. The predicted `hot spots' for the binding of these probes were compared to the actual arrangement of ligand atoms in experimentally determined protein-ligand complexes. Results indicate that the version of SuperStar that applies to

  4. Exchange bias in nearly perpendicularly coupled ferromagnetic/ferromagnetic system

    International Nuclear Information System (INIS)

    Bu, K.M.; Kwon, H.Y.; Oh, S.W.; Won, C.

    2012-01-01

    Exchange bias phenomena appear not only in ferromagnetic/antiferromagnetic systems but also in ferromagnetic/ferromagnetic systems in which two layers are nearly perpendicularly coupled. We investigated the origin of the symmetry-breaking mechanism and the relationship between the exchange bias and the system's energy parameters. We compared the results of computational Monte Carlo simulations with those of theoretical model calculation. We found that the exchange bias exhibited nonlinear behaviors, including sign reversal and singularities. These complicated behaviors were caused by two distinct magnetization processes depending on the interlayer coupling strength. The exchange bias reached a maximum at the transition between the two magnetization processes. - Highlights: ► Exchange bias phenomena are found in perpendicularly coupled F/F systems. ► Exchange bias exhibits nonlinear behaviors, including sign reversal and singularities. ► These complicated behaviors were caused by two distinct magnetization processes. ► Exchange bias reached a maximum at the transition between the two magnetization processes. ► We established an equation to maximize the exchange bias in perpendicularly coupled F/F system.

  5. Expert system for aiding fuel exchange planning

    International Nuclear Information System (INIS)

    Shiratori, Yoshitake.

    1992-01-01

    A fuel exchange plan is prepared based on intelligence bases such as a method of zoning a reactor core, a fuel arrangement rule and a procedure for fuel exchange, as well as initial data. Then, the fuel exchange plans are patterned to several groups based on the intelligence bases such as patterning of fuel arrangement. A typical pattern is analyzed by a reactor core analyzing code and allowance or rejection for the analyzed patterns is judged based on intelligence bases regarding life time of the reactor core, thermal limit value of fuels, burning of fuel for irradiation test. The result of the judgement is fed-back as an estimation information and the initial data and the intelligence data are added to prepare a plan again. A similar analysis is also conducted for the plan of the rejected group. The allowance or rejection is judged for all of the plans in the same manner. The intelligence bases are used and the result of the judgement is fed-back as a condition for estimation, thereby enabling to remarkably save labors and time and prepare non-typical exchange plans. (N.H.)

  6. Recent improvements to Binding MOAD: a resource for protein-ligand binding affinities and structures.

    Science.gov (United States)

    Ahmed, Aqeel; Smith, Richard D; Clark, Jordan J; Dunbar, James B; Carlson, Heather A

    2015-01-01

    For over 10 years, Binding MOAD (Mother of All Databases; http://www.BindingMOAD.org) has been one of the largest resources for high-quality protein-ligand complexes and associated binding affinity data. Binding MOAD has grown at the rate of 1994 complexes per year, on average. Currently, it contains 23,269 complexes and 8156 binding affinities. Our annual updates curate the data using a semi-automated literature search of the references cited within the PDB file, and we have recently upgraded our website and added new features and functionalities to better serve Binding MOAD users. In order to eliminate the legacy application server of the old platform and to accommodate new changes, the website has been completely rewritten in the LAMP (Linux, Apache, MySQL and PHP) environment. The improved user interface incorporates current third-party plugins for better visualization of protein and ligand molecules, and it provides features like sorting, filtering and filtered downloads. In addition to the field-based searching, Binding MOAD now can be searched by structural queries based on the ligand. In order to remove redundancy, Binding MOAD records are clustered in different families based on 90% sequence identity. The new Binding MOAD, with the upgraded platform, features and functionalities, is now equipped to better serve its users. © The Author(s) 2014. Published by Oxford University Press on behalf of Nucleic Acids Research.

  7. @TOME-2: a new pipeline for comparative modeling of protein-ligand complexes.

    Science.gov (United States)

    Pons, Jean-Luc; Labesse, Gilles

    2009-07-01

    @TOME 2.0 is new web pipeline dedicated to protein structure modeling and small ligand docking based on comparative analyses. @TOME 2.0 allows fold recognition, template selection, structural alignment editing, structure comparisons, 3D-model building and evaluation. These tasks are routinely used in sequence analyses for structure prediction. In our pipeline the necessary software is efficiently interconnected in an original manner to accelerate all the processes. Furthermore, we have also connected comparative docking of small ligands that is performed using protein-protein superposition. The input is a simple protein sequence in one-letter code with no comment. The resulting 3D model, protein-ligand complexes and structural alignments can be visualized through dedicated Web interfaces or can be downloaded for further studies. These original features will aid in the functional annotation of proteins and the selection of templates for molecular modeling and virtual screening. Several examples are described to highlight some of the new functionalities provided by this pipeline. The server and its documentation are freely available at http://abcis.cbs.cnrs.fr/AT2/

  8. Intuitive Density Functional Theory-Based Energy Decomposition Analysis for Protein-Ligand Interactions.

    Science.gov (United States)

    Phipps, M J S; Fox, T; Tautermann, C S; Skylaris, C-K

    2017-04-11

    First-principles quantum mechanical calculations with methods such as density functional theory (DFT) allow the accurate calculation of interaction energies between molecules. These interaction energies can be dissected into chemically relevant components such as electrostatics, polarization, and charge transfer using energy decomposition analysis (EDA) approaches. Typically EDA has been used to study interactions between small molecules; however, it has great potential to be applied to large biomolecular assemblies such as protein-protein and protein-ligand interactions. We present an application of EDA calculations to the study of ligands that bind to the thrombin protein, using the ONETEP program for linear-scaling DFT calculations. Our approach goes beyond simply providing the components of the interaction energy; we are also able to provide visual representations of the changes in density that happen as a result of polarization and charge transfer, thus pinpointing the functional groups between the ligand and protein that participate in each kind of interaction. We also demonstrate with this approach that we can focus on studying parts (fragments) of ligands. The method is relatively insensitive to the protocol that is used to prepare the structures, and the results obtained are therefore robust. This is an application to a real protein drug target of a whole new capability where accurate DFT calculations can produce both energetic and visual descriptors of interactions. These descriptors can be used to provide insights for tailoring interactions, as needed for example in drug design.

  9. LiGRO: a graphical user interface for protein-ligand molecular dynamics.

    Science.gov (United States)

    Kagami, Luciano Porto; das Neves, Gustavo Machado; da Silva, Alan Wilter Sousa; Caceres, Rafael Andrade; Kawano, Daniel Fábio; Eifler-Lima, Vera Lucia

    2017-10-04

    To speed up the drug-discovery process, molecular dynamics (MD) calculations performed in GROMACS can be coupled to docking simulations for the post-screening analyses of large compound libraries. This requires generating the topology of the ligands in different software, some basic knowledge of Linux command lines, and a certain familiarity in handling the output files. LiGRO-the python-based graphical interface introduced here-was designed to overcome these protein-ligand parameterization challenges by allowing the graphical (non command line-based) control of GROMACS (MD and analysis), ACPYPE (ligand topology builder) and PLIP (protein-binder interactions monitor)-programs that can be used together to fully perform and analyze the outputs of complex MD simulations (including energy minimization and NVT/NPT equilibration). By allowing the calculation of linear interaction energies in a simple and quick fashion, LiGRO can be used in the drug-discovery pipeline to select compounds with a better protein-binding interaction profile. The design of LiGRO allows researchers to freely download and modify the software, with the source code being available under the terms of a GPLv3 license from http://www.ufrgs.br/lasomfarmacia/ligro/ .

  10. Business Information Exchange System with Security, Privacy, and Anonymity

    Directory of Open Access Journals (Sweden)

    Sead Muftic

    2016-01-01

    Full Text Available Business Information Exchange is an Internet Secure Portal for secure management, distribution, sharing, and use of business e-mails, documents, and messages. It has three applications supporting three major types of information exchange systems: secure e-mail, secure instant messaging, and secure sharing of business documents. In addition to standard security services for e-mail letters, which are also applied to instant messages and documents, the system provides innovative features of privacy and full anonymity of users and their locations, actions, transactions, and exchanged resources. In this paper we describe design, implementation, and use of the system.

  11. System for exchanging tools and end effectors on a robot

    International Nuclear Information System (INIS)

    Burry, D.B.; Williams, P.M.

    1991-01-01

    A system and method for exchanging tools and end effectors on a robot permits exchange during a programmed task. The exchange mechanism is located off the robot, thus reducing the mass of the robot arm and permitting smaller robots to perform designated tasks. A simple spring/collet mechanism mounted on the robot is used which permits the engagement and disengagement of the tool or end effector without the need for a rotational orientation of the tool to the end effector/collet interface. As the tool changing system is not located on the robot arm no umbilical cords are located on robot. 12 figures

  12. A scalable and accurate method for classifying protein-ligand binding geometries using a MapReduce approach.

    Science.gov (United States)

    Estrada, T; Zhang, B; Cicotti, P; Armen, R S; Taufer, M

    2012-07-01

    We present a scalable and accurate method for classifying protein-ligand binding geometries in molecular docking. Our method is a three-step process: the first step encodes the geometry of a three-dimensional (3D) ligand conformation into a single 3D point in the space; the second step builds an octree by assigning an octant identifier to every single point in the space under consideration; and the third step performs an octree-based clustering on the reduced conformation space and identifies the most dense octant. We adapt our method for MapReduce and implement it in Hadoop. The load-balancing, fault-tolerance, and scalability in MapReduce allow screening of very large conformation spaces not approachable with traditional clustering methods. We analyze results for docking trials for 23 protein-ligand complexes for HIV protease, 21 protein-ligand complexes for Trypsin, and 12 protein-ligand complexes for P38alpha kinase. We also analyze cross docking trials for 24 ligands, each docking into 24 protein conformations of the HIV protease, and receptor ensemble docking trials for 24 ligands, each docking in a pool of HIV protease receptors. Our method demonstrates significant improvement over energy-only scoring for the accurate identification of native ligand geometries in all these docking assessments. The advantages of our clustering approach make it attractive for complex applications in real-world drug design efforts. We demonstrate that our method is particularly useful for clustering docking results using a minimal ensemble of representative protein conformational states (receptor ensemble docking), which is now a common strategy to address protein flexibility in molecular docking. Copyright © 2012 Elsevier Ltd. All rights reserved.

  13. Optimizing the Heat Exchanger Network of a Steam Reforming System

    DEFF Research Database (Denmark)

    Nielsen, Mads Pagh; Korsgaard, Anders Risum; Kær, Søren Knudsen

    2004-01-01

    Proton Exchange Membrane (PEM) based combined heat and power production systems are highly integrated energy systems. They may include a hydrogen production system and fuel cell stacks along with post combustion units optionally coupled with gas turbines. The considered system is based on a natural...... stationary numerical system model was used and process integration techniques for optimizing the heat exchanger network for the reforming unit are proposed. Objective is to minimize the system cost. Keywords: Fuel cells; Steam Reforming; Heat Exchanger Network (HEN) Synthesis; MINLP....... gas steam reformer along with gas purification reactors to generate clean hydrogen suited for a PEM stack. The temperatures in the various reactors in the fuel processing system vary from around 1000°C to the stack temperature at 80°C. Furthermore, external heating must be supplied to the endothermic...

  14. PL-PatchSurfer: a novel molecular local surface-based method for exploring protein-ligand interactions.

    Science.gov (United States)

    Hu, Bingjie; Zhu, Xiaolei; Monroe, Lyman; Bures, Mark G; Kihara, Daisuke

    2014-08-27

    Structure-based computational methods have been widely used in exploring protein-ligand interactions, including predicting the binding ligands of a given protein based on their structural complementarity. Compared to other protein and ligand representations, the advantages of a surface representation include reduced sensitivity to subtle changes in the pocket and ligand conformation and fast search speed. Here we developed a novel method named PL-PatchSurfer (Protein-Ligand PatchSurfer). PL-PatchSurfer represents the protein binding pocket and the ligand molecular surface as a combination of segmented surface patches. Each patch is characterized by its geometrical shape and the electrostatic potential, which are represented using the 3D Zernike descriptor (3DZD). We first tested PL-PatchSurfer on binding ligand prediction and found it outperformed the pocket-similarity based ligand prediction program. We then optimized the search algorithm of PL-PatchSurfer using the PDBbind dataset. Finally, we explored the utility of applying PL-PatchSurfer to a larger and more diverse dataset and showed that PL-PatchSurfer was able to provide a high early enrichment for most of the targets. To the best of our knowledge, PL-PatchSurfer is the first surface patch-based method that treats ligand complementarity at protein binding sites. We believe that using a surface patch approach to better understand protein-ligand interactions has the potential to significantly enhance the design of new ligands for a wide array of drug-targets.

  15. Structural analysis of protein-ligand interactions: the binding of endogenous compounds and of synthetic drugs.

    Science.gov (United States)

    Gallina, Anna M; Bork, Peer; Bordo, Domenico

    2014-02-01

    The large number of macromolecular structures deposited with the Protein Data Bank (PDB) describing complexes between proteins and either physiological compounds or synthetic drugs made it possible a systematic analysis of the interactions occurring between proteins and their ligands. In this work, the binding pockets of about 4000 PDB protein-ligand complexes were investigated and amino acid and interaction types were analyzed. The residues observed with lowest frequency in protein sequences, Trp, His, Met, Tyr, and Phe, turned out to be the most abundant in binding pockets. Significant differences between drug-like and physiological compounds were found. On average, physiological compounds establish with respect to drugs about twice as many hydrogen bonds with protein atoms, whereas drugs rely more on hydrophobic interactions to establish target selectivity. The large number of PDB structures describing homologous proteins in complex with the same ligand made it possible to analyze the conservation of binding pocket residues among homologous protein structures bound to the same ligand, showing that Gly, Glu, Arg, Asp, His, and Thr are more conserved than other amino acids. Also in the cases in which the same ligand is bound to unrelated proteins, the binding pockets showed significant conservation in the residue types. In this case, the probability of co-occurrence of the same amino acid type in the binding pockets could be up to thirteen times higher than that expected on a random basis. The trends identified in this study may provide an useful guideline in the process of drug design and lead optimization. Copyright © 2014 John Wiley & Sons, Ltd.

  16. Consistent two-dimensional visualization of protein-ligand complex series

    Directory of Open Access Journals (Sweden)

    Stierand Katrin

    2011-06-01

    Full Text Available Abstract Background The comparative two-dimensional graphical representation of protein-ligand complex series featuring different ligands bound to the same active site offers a quick insight in their binding mode differences. In comparison to arbitrary orientations of the residue molecules in the individual complex depictions a consistent placement improves the legibility and comparability within the series. The automatic generation of such consistent layouts offers the possibility to apply it to large data sets originating from computer-aided drug design methods. Results We developed a new approach, which automatically generates a consistent layout of interacting residues for a given series of complexes. Based on the structural three-dimensional input information, a global two-dimensional layout for all residues of the complex ensemble is computed. The algorithm incorporates the three-dimensional adjacencies of the active site residues in order to find an universally valid circular arrangement of the residues around the ligand. Subsequent to a two-dimensional ligand superimposition step, a global placement for each residue is derived from the set of already placed ligands. The method generates high-quality layouts, showing mostly overlap-free solutions with molecules which are displayed as structure diagrams providing interaction information in atomic detail. Application examples document an improved legibility compared to series of diagrams whose layouts are calculated independently from each other. Conclusions The presented method extends the field of complex series visualizations. A series of molecules binding to the same protein active site is drawn in a graphically consistent way. Compared to existing approaches these drawings substantially simplify the visual analysis of large compound series.

  17. Exploring the composition of protein-ligand binding sites on a large scale.

    Directory of Open Access Journals (Sweden)

    Nickolay A Khazanov

    Full Text Available The residue composition of a ligand binding site determines the interactions available for diffusion-mediated ligand binding, and understanding general composition of these sites is of great importance if we are to gain insight into the functional diversity of the proteome. Many structure-based drug design methods utilize such heuristic information for improving prediction or characterization of ligand-binding sites in proteins of unknown function. The Binding MOAD database if one of the largest curated sets of protein-ligand complexes, and provides a source of diverse, high-quality data for establishing general trends of residue composition from currently available protein structures. We present an analysis of 3,295 non-redundant proteins with 9,114 non-redundant binding sites to identify residues over-represented in binding regions versus the rest of the protein surface. The Binding MOAD database delineates biologically-relevant "valid" ligands from "invalid" small-molecule ligands bound to the protein. Invalids are present in the crystallization medium and serve no known biological function. Contacts are found to differ between these classes of ligands, indicating that residue composition of biologically relevant binding sites is distinct not only from the rest of the protein surface, but also from surface regions capable of opportunistic binding of non-functional small molecules. To confirm these trends, we perform a rigorous analysis of the variation of residue propensity with respect to the size of the dataset and the content bias inherent in structure sets obtained from a large protein structure database. The optimal size of the dataset for establishing general trends of residue propensities, as well as strategies for assessing the significance of such trends, are suggested for future studies of binding-site composition.

  18. Integrated system of nuclear reactor and heat exchanger

    International Nuclear Information System (INIS)

    McDonald, B.N.; Schluderberg, D.C.

    1977-01-01

    The invention concerns PWRs in which the heat exchanger is associated with a pressure vessel containing the core and from which it can be selectively detached. This structural configuration applies to electric power generating uses based on land or on board ships. An existing reactor of this kind is fitted with a heat exchanger in which the tubes are 'U' shaped. This particular design of heat exchangers requires that the ends of the curved tubes be solidly maintained in a tube plate of great thickness, hence difficult to handle and to fabricate and requiring unconventional fine control systems for the control rods and awkward coolant pump arrangements. These complications limit the thermal power of the system to level below 100 megawatts. On the contrary, the object of this invention is to provide a one-piece PWR reactor capable of reaching power levels of 1500 thermal megawatts at least. For this, a pressure vessel is provided in the cylindrical assembly with not only a transversal separation on a plane located between the reactor and the heat exchanger but also a cover selectively detachable which supports the fine control gear of the control rods. Removing the cover exposes a part of the heat exchanger for easy inspection and maintenance. Further, the heat exchanger can be removed totally from the pressure vessel containing the core by detaching the cylindrical part, which composes the heat exchanger section, from the part that holds the reactor core on a level with the transversal separation [fr

  19. Research on Heat Exchange Process in Aircraft Air Conditioning System

    Science.gov (United States)

    Chichindaev, A. V.

    2017-11-01

    Using of heat-exchanger-condenser in the air conditioning system of the airplane Tu-204 (Boeing, Airbus, Superjet 100, MS-21, etc.) for cooling the compressed air by the cold air with negative temperature exiting the turbine results in a number of operational problems. Mainly it’s frosting of the heat exchange surface, which is the cause of live-section channels frosting, resistance increasing and airflow in the system decreasing. The purpose of this work is to analyse the known freeze-up-fighting methods for heat-exchanger-condenser, description of the features of anti-icing protection and offering solutions to this problem. For the problem of optimizing the design of heat exchangers in this work used generalized criterion that describes the ratio of thermal resistances of cold and hot sections, which include: the ratio of the initial values of heat transfer agents flow state; heat exchange surface finning coefficients; factors which describes the ratio of operating parameters and finning area. By controlling the ratio of the thermal resistances can be obtained the desired temperature of the heat exchange surface, which would prevent freezing. The work presents the results of a numerical study of the effect of different combinations of regime and geometrical factors changes on reduction of the heat-exchanger-condenser freezing surface area, including using of variable ratio of thermal resistances.

  20. The Picture Exchange Communication System: Digital Photographs versus Picture Symbols

    Science.gov (United States)

    Jonaitis, Carmen

    2011-01-01

    The Picture Exchange Communication System (PECS) is an augmentative and alternative system (AAC) used to improve and increase communication for children with Autism Spectrum Disorder (ASD) and other developmental disorders. Research addressing the efficacy of this system is increasing; however, there is limited information published that evaluates…

  1. MANAGED FLOAT EXCHANGE RATE SYSTEM: THE SINGAPORE EXPERIENCE

    OpenAIRE

    HOE EE KHOR; JASON LEE; EDWARD ROBINSON; SAKTIANDI SUPAAT

    2007-01-01

    This paper examines the key characteristics of Singapore's exchange rate-centered monetary policy; in particular, its managed float regime which incorporates key features of the basket, band and crawl system popularized by Williamson (1998, 1999). We assess how the flexibility accorded by this framework has been advantageous in facilitating adjustment to various shocks to the economy. A characterization of the countercyclical nature of Singapore's exchange rate policy is also offered, with re...

  2. Giant spin torque in systems with anisotropic exchange interaction

    OpenAIRE

    Korenev, Vladimir L.

    2012-01-01

    Control of magnetic domain wall movement by the spin-polarized current looks promising for creation of a new generation of magnetic memory devices. A necessary condition for this is the domain wall shift by a low-density current. Here I show that a strongly anisotropic exchange interaction between mobile heavy holes and localized magnetic moments enormously increases the current-induced torque on the domain wall as compared to systems with isotropic exchange. This enables one to control the d...

  3. Internal dust recirculation system for a fluidized bed heat exchanger

    Science.gov (United States)

    Gamble, Robert L.; Garcia-Mallol, Juan A.

    1981-01-01

    A fluidized bed heat exchanger in which air is passed through a bed of particulate material containing fuel disposed in a housing. A steam/water natural circulation system is provided in a heat exchange relation to the bed and includes a steam drum disposed adjacent the bed and a tube bank extending between the steam drum and a water drum. The tube bank is located in the path of the effluent gases exiting from the bed and a baffle system is provided to separate the solid particulate matter from the effluent gases. The particulate matter is collected and injected back into the fluidized bed.

  4. PL-PatchSurfer: A Novel Molecular Local Surface-Based Method for Exploring Protein-Ligand Interactions

    Directory of Open Access Journals (Sweden)

    Bingjie Hu

    2014-08-01

    Full Text Available Structure-based computational methods have been widely used in exploring protein-ligand interactions, including predicting the binding ligands of a given protein based on their structural complementarity. Compared to other protein and ligand representations, the advantages of a surface representation include reduced sensitivity to subtle changes in the pocket and ligand conformation and fast search speed. Here we developed a novel method named PL-PatchSurfer (Protein-Ligand PatchSurfer. PL-PatchSurfer represents the protein binding pocket and the ligand molecular surface as a combination of segmented surface patches. Each patch is characterized by its geometrical shape and the electrostatic potential, which are represented using the 3D Zernike descriptor (3DZD. We first tested PL-PatchSurfer on binding ligand prediction and found it outperformed the pocket-similarity based ligand prediction program. We then optimized the search algorithm of PL-PatchSurfer using the PDBbind dataset. Finally, we explored the utility of applying PL-PatchSurfer to a larger and more diverse dataset and showed that PL-PatchSurfer was able to provide a high early enrichment for most of the targets. To the best of our knowledge, PL-PatchSurfer is the first surface patch-based method that treats ligand complementarity at protein binding sites. We believe that using a surface patch approach to better understand protein-ligand interactions has the potential to significantly enhance the design of new ligands for a wide array of drug-targets.

  5. Enhance the performance of current scoring functions with the aid of 3D protein-ligand interaction fingerprints.

    Science.gov (United States)

    Liu, Jie; Su, Minyi; Liu, Zhihai; Li, Jie; Li, Yan; Wang, Renxiao

    2017-07-18

    In structure-based drug design, binding affinity prediction remains as a challenging goal for current scoring functions. Development of target-biased scoring functions provides a new possibility for tackling this problem, but this approach is also associated with certain technical difficulties. We previously reported the Knowledge-Guided Scoring (KGS) method as an alternative approach (BMC Bioinformatics, 2010, 11, 193-208). The key idea is to compute the binding affinity of a given protein-ligand complex based on the known binding data of an appropriate reference complex, so the error in binding affinity prediction can be reduced effectively. In this study, we have developed an upgraded version, i.e. KGS2, by employing 3D protein-ligand interaction fingerprints in reference selection. KGS2 was evaluated in combination with four scoring functions (X-Score, ChemPLP, ASP, and GoldScore) on five drug targets (HIV-1 protease, carbonic anhydrase 2, beta-secretase 1, beta-trypsin, and checkpoint kinase 1). In the in situ scoring test, considerable improvements were observed in most cases after application of KGS2. Besides, the performance of KGS2 was always better than KGS in all cases. In the more challenging molecular docking test, application of KGS2 also led to improved structure-activity relationship in some cases. KGS2 can be applied as a convenient "add-on" to current scoring functions without the need to re-engineer them, and its application is not limited to certain target proteins as customized scoring functions. As an interpolation method, its accuracy in principle can be improved further with the increasing knowledge of protein-ligand complex structures and binding affinity data. We expect that KGS2 will become a practical tool for enhancing the performance of current scoring functions in binding affinity prediction. The KGS2 software is available upon contacting the authors.

  6. Calculation of absolute protein-ligand binding free energy using distributed replica sampling.

    Science.gov (United States)

    Rodinger, Tomas; Howell, P Lynne; Pomès, Régis

    2008-10-21

    Distributed replica sampling [T. Rodinger et al., J. Chem. Theory Comput. 2, 725 (2006)] is a simple and general scheme for Boltzmann sampling of conformational space by computer simulation in which multiple replicas of the system undergo a random walk in reaction coordinate or temperature space. Individual replicas are linked through a generalized Hamiltonian containing an extra potential energy term or bias which depends on the distribution of all replicas, thus enforcing the desired sampling distribution along the coordinate or parameter of interest regardless of free energy barriers. In contrast to replica exchange methods, efficient implementation of the algorithm does not require synchronicity of the individual simulations. The algorithm is inherently suited for large-scale simulations using shared or heterogeneous computing platforms such as a distributed network. In this work, we build on our original algorithm by introducing Boltzmann-weighted jumping, which allows moves of a larger magnitude and thus enhances sampling efficiency along the reaction coordinate. The approach is demonstrated using a realistic and biologically relevant application; we calculate the standard binding free energy of benzene to the L99A mutant of T4 lysozyme. Distributed replica sampling is used in conjunction with thermodynamic integration to compute the potential of mean force for extracting the ligand from protein and solvent along a nonphysical spatial coordinate. Dynamic treatment of the reaction coordinate leads to faster statistical convergence of the potential of mean force than a conventional static coordinate, which suffers from slow transitions on a rugged potential energy surface.

  7. Anion-exchange membranes in electrochemical energy systems

    NARCIS (Netherlands)

    Varcoe, J.R.; Atanassov, P.; Dekel, D.R.; Herring, A.M.; Hickner, M.A.; Kohl, P.A.; Kucernak, A. R.; Mustain, W.E.; Nijmeijer, K.; Scott, Keith; Xu, Tongwen; Zhuang, Lin

    2014-01-01

    This article provides an up-to-date perspective on the use of anion-exchange membranes in fuel cells, electrolysers, redox flow batteries, reverse electrodialysis cells, and bioelectrochemical systems (e.g. microbial fuel cells). The aim is to highlight key concepts, misconceptions, the current

  8. Training Paraprofessionals to Implement the Picture Exchange Communication System (PECS)

    Science.gov (United States)

    Sloman, Glenn Matthew

    2010-01-01

    Based on Skinner's "Verbal Behavior" (1957), the picture exchange communication system (PECS) was designed to teach children with autism functional verbal behavior. Much research has demonstrated the effectiveness and efficiency of PECS in building verbal behavior. However, because PECS training is typically presented in a group format and later…

  9. Household of care in electronic health information exchange systems

    CSIR Research Space (South Africa)

    Sibiya, Mhlupheki G

    2017-09-01

    Full Text Available by the organisation have presented the protocols and message profiles that can be used for communication among the systems within Electronic Health Information Exchange (HIE)[17, 6]. HIE “allows doctors, nurses, pharmacists, other healthcare providers and patients...

  10. Data Exchange Inventory System for Telecommunications and Systems Operations (DEXI-OTSO)

    Data.gov (United States)

    Social Security Administration — This Data Exchange Inventory (DEXI) for the Office of Telecommunications and System Operations, (OTSO) Network Troubleshooting is a browser-based inventory database...

  11. Interfacial spin cluster effects in exchange bias systems

    Energy Technology Data Exchange (ETDEWEB)

    Carpenter, R., E-mail: rc548@york.ac.uk; Vallejo-Fernandez, G.; O' Grady, K. [Department of Physics, The University of York, York YO10 5DD (United Kingdom)

    2014-05-07

    In this work, the effect of exchange bias on the hysteresis loop of CoFe is observed. The evolution of the coercivities and the shift of the hysteresis loop during the annealing process has been measured for films deposited on NiCr and Cu seed layers. Through comparison of the as deposited and field annealed loops, it is clear that for an exchange biased material, the two coercivities are due to different reversal processes. This behaviour is attributed to spin clusters at the ferromagnet/antiferromagnet interface, which behave in a similar manner to a fine particle system.

  12. Protein-Ligand Informatics Force Field (PLIff): Toward a Fully Knowledge Driven "Force Field" for Biomolecular Interactions.

    Science.gov (United States)

    Verdonk, Marcel L; Ludlow, R Frederick; Giangreco, Ilenia; Rathi, Prakash Chandra

    2016-07-28

    The Protein Data Bank (PDB) contains a wealth of data on nonbonded biomolecular interactions. If this information could be distilled down to nonbonded interaction potentials, these would have some key advantages over standard force fields. However, there are some important outstanding issues to address in order to do this successfully. This paper introduces the protein-ligand informatics "force field", PLIff, which begins to address these key challenges ( https://bitbucket.org/AstexUK/pli ). As a result of their knowledge-based nature, the next-generation nonbonded potentials that make up PLIff automatically capture a wide range of interaction types, including special interactions that are often poorly described by standard force fields. We illustrate how PLIff may be used in structure-based design applications, including interaction fields, fragment mapping, and protein-ligand docking. PLIff performs at least as well as state-of-the art scoring functions in terms of pose predictions and ranking compounds in a virtual screening context.

  13. Modeling Of Proton Exchange Membrane Fuel Cell Systems

    DEFF Research Database (Denmark)

    Nielsen, Mads Pagh

    The objective of this doctoral thesis was to develop reliable steady-state and transient component models suitable to asses-, develop- and optimize proton exchange membrane (PEM) fuel cell systems. Several components in PEM fuel cell systems were characterized and modeled. The developed component...... cell systems. Consequences of indirectly fueling PEM stacks with hydrocarbons using reforming technology were investigated using a PEM stack model including CO poisoning kinetics and a transient Simulink steam reforming system model. Aspects regarding the optimization of PEM fuel cell systems...

  14. Exchange bias of patterned systems: Model and numerical simulation

    International Nuclear Information System (INIS)

    Garcia, Griselda; Kiwi, Miguel; Mejia-Lopez, Jose; Ramirez, Ricardo

    2010-01-01

    The magnitude of the exchange bias field of patterned systems exhibits a notable increase in relation to the usual bilayer systems, where a continuous ferromagnetic film is deposited on an antiferromagnet insulator. Here we develop a model, and implement a Monte Carlo calculation, to interpret the experimental observations which is consistent with experimental results, on the basis of assuming a small fraction of spins pinned ferromagnetically in the antiferromagnetic interface layer.

  15. Accuracy comparison of several common implicit solvent models and their implementations in the context of protein-ligand binding.

    Science.gov (United States)

    Katkova, E V; Onufriev, A V; Aguilar, B; Sulimov, V B

    2017-03-01

    In this study several commonly used implicit solvent models are compared with respect to their accuracy of estimating solvation energies of small molecules and proteins, as well as desolvation penalty in protein-ligand binding. The test set consists of 19 small proteins, 104 small molecules, and 15 protein-ligand complexes. We compared predicted hydration energies of small molecules with their experimental values; the results of the solvation and desolvation energy calculations for small molecules, proteins and protein-ligand complexes in water were also compared with Thermodynamic Integration calculations based on TIP3P water model and Amber12 force field. The following implicit solvent (water) models considered here are: PCM (Polarized Continuum Model implemented in DISOLV and MCBHSOLV programs), GB (Generalized Born method implemented in DISOLV program, S-GB, and GBNSR6 stand-alone version), COSMO (COnductor-like Screening Model implemented in the DISOLV program and the MOPAC package) and the Poisson-Boltzmann model (implemented in the APBS program). Different parameterizations of the molecules were examined: we compared MMFF94 force field, Amber12 force field and the quantum-chemical semi-empirical PM7 method implemented in the MOPAC package. For small molecules, all of the implicit solvent models tested here yield high correlation coefficients (0.87-0.93) between the calculated solvation energies and the experimental values of hydration energies. For small molecules high correlation (0.82-0.97) with the explicit solvent energies is seen as well. On the other hand, estimated protein solvation energies and protein-ligand binding desolvation energies show substantial discrepancy (up to 10kcal/mol) with the explicit solvent reference. The correlation of polar protein solvation energies and protein-ligand desolvation energies with the corresponding explicit solvent results is 0.65-0.99 and 0.76-0.96 respectively, though this difference in correlations is caused

  16. Isotope anomalies in oxygen isotope exchange equilibrium systems

    International Nuclear Information System (INIS)

    Kotaka, M.

    1997-01-01

    The purpose of the present work is to elucidate the isotope anomalies in oxygen isotope exchange equilibrium systems, according to the calculations of the equilibrium constants for oxygen isotopic exchange reactions, and the calculations of the oxygen isotope separation factors between two phases. The equilibrium constants (K65, K67, K68 and K69) of 16 O- 15 O, 16 O 17 O, 16 O- 18 O, and 16 O- 19 O exchange reactions between diatomic oxides were calculated in a wide temperature range on the basis of quantum statistical mechanics. Many equilibrium constants showed the anomalous mass effects, and then had the crossover temperatures and the mass independent fractionation (MIF) temperatures which held K67 = K65, K67 = K68, or K67 = K69, etc. For example, the equilibrium constants for the reactions between OH and the other diatomic oxides (MO) showed the anomalous mass effects, when M was Li, Na, Mg, K, Fe, Al, Ge, Zr, Pt, etc. The 16 O 15 O, 16 O 17 O, 16 O- 18 O, and 16 O- 19 O oxygen isotope separation factors (S65, S67, S68 and S69) between two phases were calculated, when OH and CO were in the first phase, and SiO was in the second phase. Although the oxygen isotopic exchange equilibria in the two phases had no MIF and crossover temperatures, the separation factors showed the anomalous mass effects and had the temperatures. According to what is called the normal mass effects for the equilibrium constant of isotopic exchange reaction, the value of InK68/InK67 is 1.885. Therefore, the value of InS68/InS67 should be 1.885 too. The value calculated, however, widely changed. It can be concluded from the results obtained in the present work that some oxygen isotopic exchange equilibria cause the anomalous mass effects, the anomalous oxygen isotope separation factors, and then isotope anomalies

  17. Improvements to a Markerless Allelic Exchange System for Bacillus anthracis.

    Directory of Open Access Journals (Sweden)

    Roger D Plaut

    Full Text Available A system was previously developed for conducting I-SceI-mediated allelic exchange in Bacillus anthracis. In this system, recombinational loss of a chromosomally-integrated allelic exchange vector is stimulated by creation of a double-stranded break within the vector by the homing endonuclease I-SceI. Although this system is reasonably efficient and represents an improvement in the tools available for allelic exchange in B. anthracis, researchers are nonetheless required to "pick and patch" colonies in order to identify candidate "exchangeants." In the present study, a number of improvements have been made to this system: 1 an improved I-SceI-producing plasmid includes oriT so that both plasmids can now be introduced by conjugation, thus avoiding the need for preparing electro-competent cells of each integration intermediate; 2 antibiotic markers have been changed to allow the use of the system in select agent strains; and 3 both plasmids have been marked with fluorescent proteins, allowing the visualization of plasmid segregation on a plate and obviating the need for "picking and patching." These modifications have made the process easier, faster, and more efficient, allowing for parallel construction of larger numbers of mutant strains. Using this improved system, the genes encoding the tripartite anthrax toxin were deleted singly and in combination from plasmid pXO1 of Sterne strain 34F2. In the course of this study, we determined that DNA transfer to B. anthracis could be accomplished by conjugation directly from a methylation-competent E. coli strain.

  18. Discovery of a new chemical series of BRD4(1) inhibitors using protein-ligand docking and structure-guided design.

    Science.gov (United States)

    Duffy, Bryan C; Liu, Shuang; Martin, Gregory S; Wang, Ruifang; Hsia, Ming Min; Zhao, He; Guo, Cheng; Ellis, Michael; Quinn, John F; Kharenko, Olesya A; Norek, Karen; Gesner, Emily M; Young, Peter R; McLure, Kevin G; Wagner, Gregory S; Lakshminarasimhan, Damodharan; White, Andre; Suto, Robert K; Hansen, Henrik C; Kitchen, Douglas B

    2015-07-15

    Bromodomains are key transcriptional regulators that are thought to be druggable epigenetic targets for cancer, inflammation, diabetes and cardiovascular therapeutics. Of particular importance is the first of two bromodomains in bromodomain containing 4 protein (BRD4(1)). Protein-ligand docking in BRD4(1) was used to purchase a small, focused screening set of compounds possessing a large variety of core structures. Within this set, a small number of weak hits each contained a dihydroquinoxalinone ring system. We purchased other analogs with this ring system and further validated the new hit series and obtained improvement in binding inhibition. Limited exploration by new analog synthesis showed that the binding inhibition in a FRET assay could be improved to the low μM level making this new core a potential hit-to-lead series. Additionally, the predicted geometries of the initial hit and an improved analog were confirmed by X-ray co-crystallography with BRD4(1). Copyright © 2015 Elsevier Ltd. All rights reserved.

  19. Materials, Turbomachinery and Heat Exchangers for Supercritical CO2 Systems

    Energy Technology Data Exchange (ETDEWEB)

    Anderson, Mark; Nellis, Greg; Corradini, Michael

    2012-10-19

    The objective of this project is to produce the necessary data to evaluate the performance of the supercritical carbon dioxide cycle. The activities include a study of materials compatibility of various alloys at high temperatures, the heat transfer and pressure drop in compact heat exchanger units, and turbomachinery issues, primarily leakage rates through dynamic seals. This experimental work will serve as a test bed for model development and design calculations, and will help define further tests necessary to develop high-efficiency power conversion cycles for use on a variety of reactor designs, including the sodium fast reactor (SFR) and very high-temperature gas reactor (VHTR). The research will be broken into three separate tasks. The first task deals with the analysis of materials related to the high-temperature S-CO{sub 2} Brayton cycle. The most taxing materials issues with regard to the cycle are associated with the high temperatures in the reactor side heat exchanger and in the high-temperature turbine. The system could experience pressures as high as 20MPa and temperatures as high as 650°C. The second task deals with optimization of the heat exchangers required by the S-CO{sub 2} cycle; the S-CO{sub 2} flow passages in these heat exchangers are required whether the cycle is coupled with a VHTR or an SFR. At least three heat exchangers will be required: the pre-cooler before compression, the recuperator, and the heat exchanger that interfaces with the reactor coolant. Each of these heat exchangers is unique and must be optimized separately. The most challenging heat exchanger is likely the pre-cooler, as there is only about a 40°C temperature change but it operates close to the CO{sub 2} critical point, therefore inducing substantial changes in properties. The proposed research will focus on this most challenging component. The third task examines seal leakage through various dynamic seal designs under the conditions expected in the S-CO{sub 2} cycle

  20. Thermal Analysis for Ion-Exchange Column System

    Energy Technology Data Exchange (ETDEWEB)

    Lee, Si Y.; King, William D.

    2012-12-20

    Models have been developed to simulate the thermal characteristics of crystalline silicotitanate ion exchange media fully loaded with radioactive cesium either in a column configuration or distributed within a waste storage tank. This work was conducted to support the design and operation of a waste treatment process focused on treating dissolved, high-sodium salt waste solutions for the removal of specific radionuclides. The ion exchange column will be installed inside a high level waste storage tank at the Savannah River Site. After cesium loading, the ion exchange media may be transferred to the waste tank floor for interim storage. Models were used to predict temperature profiles in these areas of the system where the cesium-loaded media is expected to lead to localized regions of elevated temperature due to radiolytic decay. Normal operating conditions and accident scenarios (including loss of solution flow, inadvertent drainage, and loss of active cooling) were evaluated for the ion exchange column using bounding conditions to establish the design safety basis. The modeling results demonstrate that the baseline design using one central and four outer cooling tubes provides a highly efficient cooling mechanism for reducing the maximum column temperature. In-tank modeling results revealed that an idealized hemispherical mound shape leads to the highest tank floor temperatures. In contrast, even large volumes of CST distributed in a flat layer with a cylindrical shape do not result in significant floor heating.

  1. Tuning antiferromagnetic exchange interaction for spontaneous exchange bias in MnNiSnSi system

    Science.gov (United States)

    Jia, Liyun; Shen, Jianlei; Li, Mengmeng; Wang, Xi; Ma, Li; Zhen, Congmian; Hou, Denglu; Liu, Enke; Wang, Wenhong; Wu, Guangheng

    2017-12-01

    Based on almost all the data from the literature on spontaneous exchange bias (SEB), it is expected that the system will show SEB if it meets two conditions simultaneously: (i) there are the coexistence and competition of antiferromagnetic (AFM) and ferromagnetic (FM) interactions and (ii) AFM interaction should dominate but not be too strong in this competition. In order to verify this view, a systematic study on SEB has been performed in this work. Mn50Ni40Sn10 with strong FM interaction and without SEB is chosen as the mother composition, and the negative chemical pressure is introduced by the substitution of Sn by Si to enhance AFM interaction. It is found that a long-range FM ordering window is closed, and a long-range AFM ordering window is opened. As a result, SEB is triggered and a continuous tuning of the spontaneous exchange bias field (HSEB) from 0 Oe to 1300 Oe has been realized in a Mn50Ni40Sn10-xSix system by the enhanced AFM interaction.

  2. Document Management and Exchange System – Supporting Education Process

    Directory of Open Access Journals (Sweden)

    Emil Egredzija

    2010-03-01

    Full Text Available Development and implementation of new technologies are very important in education. One of the most challenging tasks in the education process is to build efficient and cost-friendly system for content management and exchange. The system has to be reliable, easy manageable and open. Centralized storage, secured access, and ubiquitous client technologies have emerged as best-practice solutions in engineering that kind of services. Users can easily publish or exchange documents and not need to worry about their distribution, storage or technical skills required for efficient document management. The system that will be presented is built on open source technologies and is deployable on all today's popular web software platforms. The web server, the programming language and operating system that are used to build and deploy such a system are all non-proprietary and completely open because our mission was to build system that can be easily extended and not limited by its corporate license. The system uses security mechanisms such as user group access policy, operating system level security (file system and secured data storage in database. Because of the growing need for document management in education process we believe that this project will find its place in practice.

  3. Development of a proton exchange membrane fuel cell cogeneration system

    Energy Technology Data Exchange (ETDEWEB)

    Hwang, Jenn Jiang; Zou, Meng Lin [Department of Greenergy, National University of Tainan, Tainan 700 (China)

    2010-05-01

    A proton exchange membrane fuel cell (PEMFC) cogeneration system that provides high-quality electricity and hot water has been developed. A specially designed thermal management system together with a microcontroller embedded with appropriate control algorithm is integrated into a PEM fuel cell system. The thermal management system does not only control the fuel cell operation temperature but also recover the heat dissipated by FC stack. The dynamic behaviors of thermal and electrical characteristics are presented to verify the stability of the fuel cell cogeneration system. In addition, the reliability of the fuel cell cogeneration system is proved by one-day demonstration that deals with the daily power demand in a typical family. Finally, the effects of external loads on the efficiencies of the fuel cell cogeneration system are examined. Results reveal that the maximum system efficiency was as high as 81% when combining heat and power. (author)

  4. Heat pipes and heat pipe exchangers for heat recovery systems

    Energy Technology Data Exchange (ETDEWEB)

    Vasiliev, L L; Grakovich, L P; Kiselev, V G; Kurustalev, D K; Matveev, Yu

    1984-01-01

    Heat pipes and heat pipe exchangers are of great importance in power engineering as a means of recovering waste heat of industrial enterprises, solar energy, geothermal waters and deep soil. Heat pipes are highly effective heat transfer units for transferring thermal energy over large distance (tens of meters) with low temperature drops. Their heat transfer characteristics and reliable working for more than 10-15 yr permit the design of new systems with higher heat engineering parameters.

  5. Data exchange system in cooler-storage-ring virtual accelerator

    International Nuclear Information System (INIS)

    Liu Wufeng; Qiao Weimin; Jing Lan; Guo Yuhui

    2009-01-01

    The data exchange system of the cooler-storage-ring (CSR) control system for heavy ion radiotherapy has been introduced for the heavy ion CSR at Lanzhou (HIRFL-CSR). Using techniques of Java, component object model (COM), Oracle, DSP and FPGA, this system can achieve real-time control of magnet power supplies sanctimoniously, and control beams and their switching in 256 energy levels. It has been used in the commissioning of slow extraction for the main CSR (CSRm), showing stable and reliable performance. (authors)

  6. Screening small-molecule compound microarrays for protein ligands without fluorescence labeling with a high-throughput scanning microscope.

    Science.gov (United States)

    Fei, Yiyan; Landry, James P; Sun, Yungshin; Zhu, Xiangdong; Wang, Xiaobing; Luo, Juntao; Wu, Chun-Yi; Lam, Kit S

    2010-01-01

    We describe a high-throughput scanning optical microscope for detecting small-molecule compound microarrays on functionalized glass slides. It is based on measurements of oblique-incidence reflectivity difference and employs a combination of a y-scan galvometer mirror and an x-scan translation stage with an effective field of view of 2 cm x 4 cm. Such a field of view can accommodate a printed small-molecule compound microarray with as many as 10,000 to 20,000 targets. The scanning microscope is capable of measuring kinetics as well as endpoints of protein-ligand reactions simultaneously. We present the experimental results on solution-phase protein reactions with small-molecule compound microarrays synthesized from one-bead, one-compound combinatorial chemistry and immobilized on a streptavidin-functionalized glass slide.

  7. A Critical Review of Validation, Blind Testing, and Real- World Use of Alchemical Protein-Ligand Binding Free Energy Calculations.

    Science.gov (United States)

    Abel, Robert; Wang, Lingle; Mobley, David L; Friesner, Richard A

    2017-01-01

    Protein-ligand binding is among the most fundamental phenomena underlying all molecular biology, and a greater ability to more accurately and robustly predict the binding free energy of a small molecule ligand for its cognate protein is expected to have vast consequences for improving the efficiency of pharmaceutical drug discovery. We briefly reviewed a number of scientific and technical advances that have enabled alchemical free energy calculations to recently emerge as a preferred approach, and critically considered proper validation and effective use of these techniques. In particular, we characterized a selection bias effect which may be important in prospective free energy calculations, and introduced a strategy to improve the accuracy of the free energy predictions. Copyright© Bentham Science Publishers; For any queries, please email at epub@benthamscience.org.

  8. Exact and Effective Pair-Wise Potential for Protein-Ligand Interactions Obtained from a Semiempirical Energy Partition

    Directory of Open Access Journals (Sweden)

    André Melo

    2008-09-01

    Full Text Available In this work, the partition method introduced by Carvalho and Melo was used to study the complex between Cucurbita maxima trypsin inhibitor (CMTI-I and glycerol at the AM1 level. An effective potential, combining non-bonding and polarization plus charge transfer (PLCT terms, was introduced to evaluate the magnitude of the interaction between each amino acid and the ligand. In this case study, the nonbonding–PLCT noncompensation characterizes the stabilization energy of the association process in study. The main residues (Gly29, Cys3 and Arg5 with net attractive effects and Arg1 (with a net repulsive effect, responsible by the stability of protein-ligand complex, are associated with large nonbonding energies non-compensated by PLCT effects. The results obtained enable us to conclude that the present decomposition scheme can be used for understanding the cohesive phenomena in proteins.

  9. Exchange interactions in two-state systems: rare earth pyrochlores

    Science.gov (United States)

    Curnoe, S. H.

    2018-06-01

    The general form of the nearest neighbour exchange interaction for rare earth pyrochlores is derived based on symmetry. Generally, the rare earth angular momentum degeneracy is lifted by the crystal electric field (CEF) into singlets and doublets. When the CEF ground state is a doublet that is well-separated from the first excited state the CEF ground state doublet can be treated as a pseudo-spin of some kind. The general form of the nearest neighbour exchange interaction for pseudo-spins on the pyrochlore lattice is derived for three different types of pseudo-spins. The methodology presented in this paper can be applied to other two-state spin systems with a high space group symmetry.

  10. Exchange of pressurizer safeguarding system at Biblis nuclear power station

    International Nuclear Information System (INIS)

    Weber, D.; Hofbeck, W.

    1991-01-01

    Valves and piping of the pressurizer safeguarding system are exchanged and reset in such a way that they are suitable not only for discharging steam, but also for discharging a water-steam mixture and hot pressurized water; for the emergency measure of primary depressurization by hand (bleed) in the event of failure of the entire feedwater supply and station black-out, and in the event of operational transients with supposed failure of the reactor scram (ATWS). To achieve this, in addition to the requirements of the pressurizer discharging station, changes have to be made to the valve drive to dominate the water loads. During the 1990 inspection this exchange of the pressurizer discharging station was performed at the Biblis A unit as the first German plant. (orig.) [de

  11. Community Exchange Systems. What They Are. How They Work. How to Set One Up.

    Science.gov (United States)

    Page, Leslie

    This booklet explains the concept of a community exchange system (CES), or barter system, for the exchange of goods and services and describes how to set one up. The booklet is concerned only with nonprofit, voluntary organizations. The booklet is organized in four sections. The first section introduces the community exchange systems idea and…

  12. Capital Controls and Foreign Investor Subsidies Implicit in South Africa's Dual Exchange Rate System

    NARCIS (Netherlands)

    Huizinga, H.P.; Schaling, E.; van der Windt, P.C.

    2007-01-01

    Both in theory and practice, capital controls and dual exchange rate systems can be part of a country's optimal tax policy. We first show how a dual exchange rate system can be interpreted as a tax (or subsidy) on international capital income. We show that a dual exchange rate system, with separate

  13. Are expert systems needed on the power exchange?

    International Nuclear Information System (INIS)

    Nilsson, David.

    1991-09-01

    The goal of this masters thesis is to investigate whether it is possible to improve the activities at the power production unit (PDP) at Sydkraft with the help of expert systems. Another goal is that the produced result should work as an education material for the production operators. Therefore the work contains a detailed description of the power exchange and the factors that influence it, in addition to a description of the work tasks of the operators. The conclusions are, first, that an embedded critiquing system would enable a quicker training of new operators, while also giving the more experienced operators feedback on their decisions. Secondly, the water storage operation should be documented, to create a basis for the development of an expert system, and to create more material for education. The thesis also suggests a new model for the development of expert systems in areas where it is not known whether such a solution is possible. (au)

  14. Fluctuation relation for heat exchange in Markovian open quantum systems

    Science.gov (United States)

    Ramezani, M.; Golshani, M.; Rezakhani, A. T.

    2018-04-01

    A fluctuation relation for the heat exchange of an open quantum system under a thermalizing Markovian dynamics is derived. We show that the probability that the system absorbs an amount of heat from its bath, at a given time interval, divided by the probability of the reverse process (releasing the same amount of heat to the bath) is given by an exponential factor which depends on the amount of heat and the difference between the temperatures of the system and the bath. Interestingly, this relation is akin to the standard form of the fluctuation relation (for forward-backward dynamics). We also argue that the probability of the violation of the second law of thermodynamics in the form of the Clausius statement (i.e., net heat transfer from a cold system to its hot bath) drops exponentially with both the amount of heat and the temperature differences of the baths.

  15. The Software Bus, an Object-Oriented Data Exchange System

    International Nuclear Information System (INIS)

    Akerbaek, T.; Louka, M.

    1996-01-01

    This document describes the Software Bus System, developed for object-oriented task to task communication in a TCP/IP based network. The Software Bus is a set of library functions, developed to be used for the Picasso-3 UIMS, and as a general purpose tool for dynamically interfacing programs at run-time. The Software Bus offers a high level object-oriented data exchange mechanism that relieves the application programmer of the low level TCP/IP-programming and communication protocol handling. The Software Bus is currently available under several UNIX platforms and a version for Windows NT is planned for late 1996. (author)

  16. Design of systems for handling radioactive ion exchange resin beads

    International Nuclear Information System (INIS)

    Shapiro, S.A.; Story, G.L.

    1979-01-01

    The flow of slurries in pipes is a complex phenomenon. There are little slurry data available on which to base the design of systems for radioactive ion exchange resin beads and, as a result, the designs vary markedly in operating plants. With several plants on-line, the opportunity now exists to evaluate the designs of systems handling high activity spent resin beads. Results of testing at Robbins and Meyers Pump Division to quantify the behavior of resin bead slurries are presented. These tests evaluated the following slurry parameters; resin slurry velocity, pressure drop, bead degradation, and slurry concentration effects. A discussion of the general characteristics of resin bead slurries is presented along with a correlation to enable the designer to establish the proper flowrate for a given slurry composition and flow regime as a function of line size. Guidelines to follow in designing a resin handling system are presented

  17. Membrane heat exchanger in HVAC energy recovery systems, systems energy analysis

    Energy Technology Data Exchange (ETDEWEB)

    Nasif, M. [School of Mechanical and Manufacturing Engineering, The University of New South Wales, Sydney, NSW 2052 (Australia); Opus International Consultants (New Zealand); AL-Waked, R. [Mechanical Engineering Department, Prince Mohammad Bin Fahd University (PMU), P.O. Box 1614, AlKhobar 31952 (Saudi Arabia); Morrison, G. [School of Mechanical and Manufacturing Engineering, The University of New South Wales, Sydney, NSW 2052 (Australia); Behnia, M. [School of Aerospace, Mechanical and Mechatronic Engineering, University of Sydney, NSW 2006 (Australia)

    2010-10-15

    The thermal performance of an enthalpy/membrane heat exchanger is experimentally investigated. The heat exchanger utilizes a 60gsm Kraft paper as the heat and moisture transfer surface for HVAC energy recovery. The heat exchanger sensible, latent and total effectiveness have been determined through temperature and moisture content measurements. The annual energy consumption of an air conditioner coupled with an enthalpy/membrane heat exchanger is also studied and compared with a conventional air conditioning cycle using in-house modified HPRate software. The heat exchanger effectiveness are used as thermal performance indicators and incorporated in the modified software. Energy analysis showed that an air conditioning system coupled with a membrane heat exchanger consumes less energy than a conventional air conditioning system in hot and humid climates where the latent load is high. It has been shown that in humid climate a saving of up to 8% in annual energy consumption can be achieved when membrane heat exchanger is used instead of a conventional HVAC system. (author)

  18. Standards, Data Exchange and Intellectual Property Rights in Systems Biology

    DEFF Research Database (Denmark)

    van Zimmeren, Esther; Rutz, Berthold; Minssen, Timo

    2016-01-01

    ” of scientists. In 2015, Biotechnology Journal published a report from an expert meeting on “Synthetic Biology & Intellectual Property Rights” organized by the Danish Agency for Science, Technology and Innovation sponsored by the European Research Area Network (ERA-Net) in Synthetic Biology (ERASynBio), in which...... we provided a number of recommendations for a variety of stakeholders. The current article offers some deeper reflections about the interface between IPRs, standards and data exchange in Systems Biology resulting from an Expert Meeting funded by another ERA-Net, ERASysAPP. The meeting brought...... together experts and stakeholders (e.g. scientists, company representatives, officials from public funding organizations) in systems biology (SysBio) from different countries.  Despite the different profiles of the stakeholders at the meeting and the variety of interests, many concerns and opinions were...

  19. Electronic bulletin board system for image and information exchange

    International Nuclear Information System (INIS)

    Halama, J.R.; Henkin, R.E.; Wagner, R.H.

    1990-01-01

    This paper provides nuclear medicine professionals access to an electronic bulletin board (EBB) for image and information exchange. EBB users access the system remotely via modem and personal computer. A public message board is maintained containing messages posted by users. New messages or replies to existing messages may be posted. A public library board contains documents and images for users to access by transmitting them locally for off-line review. Comments and replies may be posted in the library board. New files may be posted in the library at any time. The EBB programs were developed on a multi-user computer system, allowing simultaneous access of users and on-line conferencing among active users

  20. Advanced integrated solvent extraction and ion exchange systems

    International Nuclear Information System (INIS)

    Horwitz, P.

    1996-01-01

    Advanced integrated solvent extraction (SX) and ion exchange (IX) systems are a series of novel SX and IX processes that extract and recover uranium and transuranics (TRUs) (neptunium, plutonium, americium) and fission products 90 Sr, 99 Tc, and 137 Cs from acidic high-level liquid waste and that sorb and recover 90 Sr, 99 Tc, and 137 Cs from alkaline supernatant high-level waste. Each system is based on the use of new selective liquid extractants or chromatographic materials. The purpose of the integrated SX and IX processes is to minimize the quantity of waste that must be vitrified and buried in a deep geologic repository by producing raffinates (from SX) and effluent streams (from IX) that will meet the specifications of Class A low-level waste

  1. Exchanging large data object in multi-agent systems

    Science.gov (United States)

    Al-Yaseen, Wathiq Laftah; Othman, Zulaiha Ali; Nazri, Mohd Zakree Ahmad

    2016-08-01

    One of the Business Intelligent solutions that is currently in use is the Multi-Agent System (MAS). Communication is one of the most important elements in MAS, especially for exchanging large low level data between distributed agents (physically). The Agent Communication Language in JADE has been offered as a secure method for sending data, whereby the data is defined as an object. However, the object cannot be used to send data to another agent in a different location. Therefore, the aim of this paper was to propose a method for the exchange of large low level data as an object by creating a proxy agent known as a Delivery Agent, which temporarily imitates the Receiver Agent. The results showed that the proposed method is able to send large-sized data. The experiments were conducted using 16 datasets ranging from 100,000 to 7 million instances. However, for the proposed method, the RAM and the CPU machine had to be slightly increased for the Receiver Agent, but the latency time was not significantly different compared to the use of the Java Socket method (non-agent and less secure). With such results, it was concluded that the proposed method can be used to securely send large data between agents.

  2. A Controlled Environment System For Measuring Plant-Atmosphere Gas Exchange

    Science.gov (United States)

    James M. Brown

    1975-01-01

    Describes an inexpensive, efficient system for measuring plant-atmosphere gas exchange. Designed to measure transpiration from potted tree seedlings, it is readily adaptable for measuring other gas exchanges or gas exchange by plant parts. Light level, air and root temperature can be precisely controlled at minimum cost.

  3. Improving performance in the ED through laboratory information exchange systems.

    Science.gov (United States)

    Raymond, Louis; Paré, Guy; Maillet, Éric; Ortiz de Guinea, Ana; Trudel, Marie-Claude; Marsan, Josianne

    2018-03-12

    The accessibility of laboratory test results is crucial to the performance of emergency departments and to the safety of patients. This study aims to develop a better understanding of which laboratory information exchange (LIE) systems emergency care physicians (ECPs) are using to consult their patients' laboratory test results and which benefits they derive from such use. A survey of 163 (36%) ECPs in Quebec was conducted in collaboration with the Quebec's Department of Health and Social Services. Descriptive statistics, chi-square tests, cluster analyses, and ANOVAs were conducted. The great majority of respondents indicated that they use several LIE systems including interoperable electronic health record (iEHR) systems, laboratory results viewers (LRVs), and emergency department information systems (EDIS) to consult their patients' laboratory results. Three distinct profiles of LIE users were observed. The extent of LIE usage was found to be primarily determined by the functional design differences between LIE systems available in the EDs. Our findings also indicate that the more widespread LIE usage, the higher the perceived benefits. More specifically, physicians who make extensive use of iEHR systems and LRVs obtain the widest range of benefits in terms of efficiency, quality, and safety of emergency care. Extensive use of LIE systems allows ECPs to better determine and monitor the health status of their patients, verify their diagnostic assumptions, and apply evidence-based practices in laboratory medicine. But for such benefits to be possible, ECPs must be provided with LIE systems that produce accurate, up-to-date, complete, and easy-to-interpret information.

  4. High pressure as a tool for investigating protein-ligand interactions

    International Nuclear Information System (INIS)

    Marchal, S; Lange, R; Tortora, P; Balny, C

    2004-01-01

    In recent years, the application of pressure on biological systems has gained increasing interest. Pressure-induced destabilization of electrostatic and hydrophobic interactions is currently exploited to study conformational protein stability and macromolecular assemblies of proteins. Due to links between severe human pathologies and ordered protein oligomerization into aggregates, which have become apparent, a better knowledge of the molecular and structural determinants that ensure the packing efficiency and stability of such complexes has taken on special importance. Here, we report the effect of pressure on the property of human ataxin-3 of aggregation. The results indicate the importance of its polyglutamine chain length in the stability and the tendency of the protein to form spheroids. Partial unfolding of the protein leading to solvent exposure of hydrophobic domains appears to be a prerequisite in the aggregation process of ataxin-3

  5. Choice of optimal exchange rate system For the Republic of Croatia

    Directory of Open Access Journals (Sweden)

    Dražen Koški

    2008-12-01

    Full Text Available The aim of research whose results are presented in this article was to choose the optimal system of exchange rate for the Republic of Croatia, of course before its accession to EU. The analyzed exchange rate systems here range from free-floating exchange rate to system without domestic currency in circulation. Naturally, the classification of International Monetary Fond is included in it. After that, the comparison of basic economic advantages and disadvantages of the fixed exchange rate in relation to floating exchange rate were carried out. Although the question is about the extreme systems, disregarding the system without domestic currency in circulation, their comparison makes possible completely satisfactory basis for the right conclusions on the choice of optimal exchange rate system for the Republic of Croatia. Considering its economic particularities, the system of managed-floating exchange rate without proclaimed exchange direction in advance is certainly optimal for the Republic of Croatia. Namely, within the framework of this system the limited floating exchange rates decrease the foreign exchange risk allowing to monetary authorities, at least partly, the independent monetary policy

  6. Application of metal foam heat exchangers for a high-performance liquefied natural gas regasification system

    International Nuclear Information System (INIS)

    Kim, Dae Yeon; Sung, Tae Hong; Kim, Kyung Chun

    2016-01-01

    The intermediate fluid vaporizer has wide applications in the regasification of LNG (liquefied natural gas). The heat exchanger performance is one of the main contributors to the thermodynamic and cost effectiveness of the entire LNG regasification system. Within the paper, the authors discuss a new concept for a compact heat exchanger with a micro-cellular structure medium to minimize volume and mass and to increase thermal efficiency. Numerical calculations have been conducted to design a metal-foam filled plate heat exchanger and a shell-and-tube heat exchanger using published experimental correlations. The geometry of both heat exchangers was optimized using the conditions of thermolators in LNG regasification systems. The heat transfer and pressure drop performance was predicted to compare the heat exchangers. The results show that the metal-foam plate heat exchanger has the best performance at different channel heights and mass flow rates of fluid. In the optimized configurations, the metal-foam plate heat exchanger has a higher heat transfer rate and lower pressure drop than the shell-and-tube heat exchanger as the mass flow rate of natural gas is increased. - Highlights: • A metal foam heat exchanger is proposed for LNG regasification system. • Comparison was made with a shell and tube heat exchanger. • Heat transfer and pressure drop characteristics were estimated. • The geometry of both heat exchangers is optimized for thermolators. • It can be used as a compact and high performance thermolators.

  7. Ion-exchange equilibrium of Fe3+-Cl- and UO22+-Cl- systems in a porous anion exchanger

    International Nuclear Information System (INIS)

    Takeda, Kunihiko; Kawakami, Fumiaki; Sasaki, Mitsunaga

    1985-01-01

    The ion-exchange equilibrium behavior of complex ions was investigatided in the systems of UO 2 2+ - Cl - and Fe 3+ - Cl - using an anion exchanger. It was performed by examining the dependency of adsorption distribution and selectivity of complexes on the micro structure of ion-exchangers, and temperature-dependency of selectivity. Changes in micropore structure of the ion-exchanger were found to have a significant effect on selectivity; the coefficient of selectivity and the average valence of the adsorbed species increased as the discrete pore ratio used as the index for pore structure decreased. In this study, equilibrium reactions were regarded as a sort of addition reaction for a easier analysis. This analysis based on the concept of addition chemical potential suggested that decreases in the discrete pore ratio were advantageous for the adsorption of complex ion species with higher valence, and average valence of the adsorbed species within the exchanger was shifted to the higher side. For this reason, it is assumed that the coefficient of selectivity became larger with a decrease in the discrete pore ratio. There is also a marked change in the coefficient of selectivity with temperature, and this becomes greater the higher the temperature. The ΔH of the present system accompanying the complex forming reaction is estimated to be 7 to 8 kcal/mol, and this value suggests that the temperature effect of the complex forming reaction contributes greatly to the change in selectivity with temperature. (author)

  8. Isotope exchange reaction in uranous-uranyl-sulphuric acid system

    International Nuclear Information System (INIS)

    Ling Daren; Yue Tingsheng; Mu Dehai; Wang Yani

    1990-01-01

    The kinetics of the isotope exchange reaction between U(IV) and U(VI) has been studied in low concentrations of sulphuric acid. A minimum exchange rate appears at 0.25 M H 2 SO 4 . From the rates at different temperatures ranging from 20deg to 35deg C, an apparent activation energy of 86 kcal/mole was calculated. The exchange rate was found to be accelerated by the addition of ferrous ions, and a half-life of less than 1 s, was obtained. Probable mechanisms for the acceleration of the uranium isotope exchange reactions by acidity and ferrous ions are proposed. (orig.)

  9. Magnetic levitation as a platform for competitive protein-ligand binding assays.

    Science.gov (United States)

    Shapiro, Nathan D; Soh, Siowling; Mirica, Katherine A; Whitesides, George M

    2012-07-17

    This paper describes a method based on magnetic levitation (MagLev) that is capable of indirectly measuring the binding of unlabeled ligands to unlabeled protein. We demonstrate this method by measuring the affinity of unlabeled bovine carbonic anhydrase (BCA) for a variety of ligands (most of which are benzene sulfonamide derivatives). This method utilizes porous gel beads that are functionalized with a common aryl sulfonamide ligand. The beads are incubated with BCA and allowed to reach an equilibrium state in which the majority of the immobilized ligands are bound to BCA. Since the beads are less dense than the protein, protein binding to the bead increases the overall density of the bead. This change in density can be monitored using MagLev. Transferring the beads to a solution containing no protein creates a situation where net protein efflux from the bead is thermodynamically favorable. The rate at which protein leaves the bead for the solution can be calculated from the rate at which the levitation height of the bead changes. If another small molecule ligand of BCA is dissolved in the solution, the rate of protein efflux is accelerated significantly. This paper develops a reaction-diffusion (RD) model to explain both this observation, and the physical-organic chemistry that underlies it. Using this model, we calculate the dissociation constants of several unlabeled ligands from BCA, using plots of levitation height versus time. Notably, although this method requires no electricity, and only a single piece of inexpensive equipment, it can measure accurately the binding of unlabeled proteins to small molecules over a wide range of dissociation constants (K(d) values within the range from ~10 nM to 100 μM are measured easily). Assays performed using this method generally can be completed within a relatively short time period (20 min-2 h). A deficiency of this system is that it is not, in its present form, applicable to proteins with molecular weight greater

  10. Choice of optimal exchange rate system For the Republic of Croatia

    OpenAIRE

    Dražen Koški

    2008-01-01

    The aim of research whose results are presented in this article was to choose the optimal system of exchange rate for the Republic of Croatia, of course before its accession to EU. The analyzed exchange rate systems here range from free-floating exchange rate to system without domestic currency in circulation. Naturally, the classification of International Monetary Fond is included in it. After that, the comparison of basic economic advantages and disadvantages of the fixed exchan...

  11. Compact Water Vapor Exchanger for Regenerative Life Support Systems

    Science.gov (United States)

    Izenson, Michael G.; Chen, Weibo; Anderson, Molly; Hodgson, Edward

    2012-01-01

    Thermal and environmental control systems for future exploration spacecraft must meet challenging requirements for efficient operation and conservation of resources. Regenerative CO2 removal systems are attractive for these missions because they do not use consumable CO2 absorbers. However, these systems also absorb and vent water to space along with carbon dioxide. This paper describes an innovative device designed to minimize water lost from regenerative CO2 control systems. Design studies and proof-of-concept testing have shown the feasibility of a compact, efficient membrane water vapor exchanger (WVX) that will conserve water while meeting challenging requirements for operation on future spacecraft. Compared to conventional WVX designs, the innovative membrane WVX described here has the potential for high water recovery efficiency, compact size, and very low pressure losses. The key innovation is a method for maintaining highly uniform flow channels in a WVX core built from water-permeable membranes. The proof-of-concept WVX incorporates all the key design features of a prototypical unit, except that it is relatively small scale (1/23 relative to a unit sized for a crew of six) and some components were fabricated using non-prototypical methods. The proof-of-concept WVX achieved over 90% water recovery efficiency in a compact core in good agreement with analysis models. Furthermore the overall pressure drop is very small (less than 0.5 in. H2O, total for both flow streams) and meets requirements for service in environmental control and life support systems on future spacecraft. These results show that the WVX provides very uniform flow through flow channels for both the humid and dry streams. Measurements also show that CO2 diffusion through the water-permeable membranes will have negligible effect on the CO2 partial pressure in the spacecraft atmosphere.

  12. Slow Histidine H/D Exchange Protocol for Thermodynamic Analysis of Protein Folding and Stability using Mass Spectrometry

    OpenAIRE

    Tran, Duc T.; Banerjee, Sambuddha; Alayash, Abdu I.; Crumbliss, Alvin L.; Fitzgerald, Michael C.

    2012-01-01

    Described here is a mass spectrometry based protocol to study the thermodynamic stability of proteins and protein-ligand complexes using the slow H/D exchange reaction of the imidazole C2 proton in histidine side chains. The protocol, which involves evaluating the denaturant dependence of this slow H/D exchange reaction in proteins, allows the global and/or subglobal unfolding/refolding properties of proteins and protein-ligand complexes to be probed. The protocol is developed using several m...

  13. Discovering protein-ligand chalcogen bonding in the protein data bank using endocyclic sulfur-containing heterocycles as ligand search subsets.

    Science.gov (United States)

    Mitchell, Miguel O

    2017-09-24

    The chalcogen bond, the noncovalent, electrostatic attraction between covalently bonded atoms in group 16 and Lewis bases, is present in protein-ligand interactions based on X-ray structures deposited in the Protein Data Bank (PDB). Discovering protein-ligand chalcogen bonding in the PDB employed a strategy that focused on searching the database for protein complexes of five-membered, heterocyclic ligands containing endocyclic sulfur with endo electron-withdrawing groups (isothiazoles; thiazoles; 1,2,3-, 1,2.4-, 1,2,5-, 1,3,4-thiadiazoles) and thiophenes with exo electron-withdrawing groups, e.g., 2-chloro, 2-bromo, 2-amino, 2-alkylthio. Out of 930 ligands investigated, 33 or 3.5% have protein-ligand S---O interactions of which 31 are chalcogen bonds and two appear to be S---HO hydrogen bonds. The bond angles for some of the chalcogen bonds found in the PDB are less than 90°, and an electrostatic model is proposed to explain this phenomenon.

  14. PLASS: Protein-ligand affinity statistical score a knowledge-based force-field model of interaction derived from the PDB

    Science.gov (United States)

    Ozrin, V. D.; Subbotin, M. V.; Nikitin, S. M.

    2004-04-01

    We have developed PLASS (Protein-Ligand Affinity Statistical Score), a pair-wise potential of mean-force for rapid estimation of the binding affinity of a ligand molecule to a protein active site. This scoring function is derived from the frequency of occurrence of atom-type pairs in crystallographic complexes taken from the Protein Data Bank (PDB). Statistical distributions are converted into distance-dependent contributions to the Gibbs free interaction energy for 10 atomic types using the Boltzmann hypothesis, with only one adjustable parameter. For a representative set of 72 protein-ligand structures, PLASS scores correlate well with the experimentally measured dissociation constants: a correlation coefficient R of 0.82 and RMS error of 2.0 kcal/mol. Such high accuracy results from our novel treatment of the volume correction term, which takes into account the inhomogeneous properties of the protein-ligand complexes. PLASS is able to rank reliably the affinity of complexes which have as much diversity as in the PDB.

  15. Control of Anther Cell Differentiation by the Small Protein Ligand TPD1 and Its Receptor EMS1 in Arabidopsis.

    Directory of Open Access Journals (Sweden)

    Jian Huang

    2016-08-01

    Full Text Available A fundamental feature of sexual reproduction in plants and animals is the specification of reproductive cells that conduct meiosis to form gametes, and the associated somatic cells that provide nutrition and developmental cues to ensure successful gamete production. The anther, which is the male reproductive organ in seed plants, produces reproductive microsporocytes (pollen mother cells and surrounding somatic cells. The microsporocytes yield pollen via meiosis, and the somatic cells, particularly the tapetum, are required for the normal development of pollen. It is not known how the reproductive cells affect the differentiation of these somatic cells, and vice versa. Here, we use molecular genetics, cell biological, and biochemical approaches to demonstrate that TPD1 (TAPETUM DETERMINANT1 is a small secreted cysteine-rich protein ligand that interacts with the LRR (Leucine-Rich Repeat domain of the EMS1 (EXCESS MICROSPOROCYTES1 receptor kinase at two sites. Analyses of the expressions and localizations of TPD1 and EMS1, ectopic expression of TPD1, experimental missorting of TPD1, and ablation of microsporocytes yielded results suggesting that the precursors of microsporocyte/microsporocyte-derived TPD1 and pre-tapetal-cell-localized EMS1 initially promote the periclinal division of secondary parietal cells and then determine one of the two daughter cells as a functional tapetal cell. Our results also indicate that tapetal cells suppress microsporocyte proliferation. Collectively, our findings show that tapetal cell differentiation requires reproductive-cell-secreted TPD1, illuminating a novel mechanism whereby signals from reproductive cells determine somatic cell fate in plant sexual reproduction.

  16. Thermal energy storage systems using fluidized bed heat exchangers

    Science.gov (United States)

    Weast, T.; Shannon, L.

    1980-06-01

    A rotary cement kiln and an electric arc furnace were chosen for evaluation to determine the applicability of a fluid bed heat exchanger (FBHX) for thermal energy storage (TES). Multistage shallow bed FBHX's operating with high temperature differences were identified as the most suitable for TES applications. Analysis of the two selected conceptual systems included establishing a plant process flow configuration, an operational scenario, a preliminary FBHX/TES design, and parametric analysis. A computer model was developed to determine the effects of the number of stages, gas temperatures, gas flows, bed materials, charge and discharge time, and parasitic power required for operation. The maximum national energy conservation potential of the cement plant application with TES is 15.4 million barrels of oil or 3.9 million tons of coal per year. For the electric arc furnance application the maximum national conservation potential with TES is 4.5 million barrels of oil or 1.1 million tons of coal per year. Present time of day utility rates are near the breakeven point required for the TES system. Escalation of on-peak energy due to critical fuel shortages could make the FBHX/TES applications economically attractive in the future.

  17. Electrical equivalent circuit of an ion-exchange membrane system

    Energy Technology Data Exchange (ETDEWEB)

    Nikonenko, Victor V., E-mail: v_nikonenko@mail.r [Membrane Institute, Kuban State University, Krasnodar (Russian Federation); Kozmai, Anton E. [Membrane Institute, Kuban State University, Krasnodar (Russian Federation)

    2011-01-01

    Usually, the current flowing through an electrochemical cell is divided into the faradaic current going to an electrochemical interface reaction, and the current charging electric double layer (EDL). This division leads to the Randles-Ershler equivalent circuit with an EDL capacitance in one branch, and the faradaic impedance in the other, specific for each particular system. However, the physics of the separation of the impedance into faradaic and capacitive components for different electrochemical systems is not sufficiently clear. The most of derivations resulting in the formal construction of the Randles-Ershler or similar equivalent circuits are based on the a priori separation of the electroneutral and the double-layer regions. In this paper, we derive an equation for the impedance of a three-layer system consisted of an ion-exchange membrane and two adjoining diffusion boundary layers (DBL) starting from the Poisson equation. The system is polarized by a constant electric current over which a small sinusoidal signal is applied. The equation shows that the impedance of the considered system can be formally interpreted via an equivalent circuit with a frequency dependent capacitance in one branch and a finite-length Warburg-type impedance in the other. To take into account this dependence, the impedance of the system may be presented as a series connection of five circuits. Three of them are consisted of a geometric capacitance connected in parallel with an ohmic resistance, respectively, for both diffusion layers and for the membrane bulk; the two others being the double-layer capacitance in parallel with the finite-length Warburg impedance for the left and the right interfaces, respectively. The comparison of the impedance spectra calculated within our analytical approach with those obtained by the full numerical solution of the Nernst-Planck-Poisson (NPP) equations shows a good agreement. Different possible situations, which might arise in real systems

  18. Application of ion exchange resin in floating drug delivery system.

    Science.gov (United States)

    Upadhye, Abhijeet A; Ambike, Anshuman A; Mahadik, Kakasaheb R; Paradkar, Anant

    2008-10-01

    The purpose of this study was to explore the application of low-density ion exchange resin (IER) Tulsion(R) 344, for floating drug delivery system (FDDS), and study the effect of its particle size on rate of complexation, water uptake, drug release, and in situ complex formation. Batch method was used for the preparation of complexes, which were characterized by physical methods. Tablet containing resin with high degree of crosslinking showed buoyancy lag time (BLT) of 5-8 min. Decreasing the particle size of resin showed decrease in water uptake and drug release, with no significant effect on the rate of complexation and in situ complex formation for both preformed complexes (PCs) and physical mixtures (PMs). Thus, low-density and high degree of crosslinking of resin and water uptake may be the governing factor for controlling the initial release of tablet containing PMs but not in situ complex formation. However, further sustained release may be due to in situ complex formation.

  19. New counter flow heat exchanger designed for ventilation systems in cold climates

    DEFF Research Database (Denmark)

    Kragh, Jesper; Rose, Jørgen; Nielsen, Toke Rammer

    2007-01-01

    In cold climates, mechanical ventilation systems with highly efficient heat recovery will experience problems with condensing water from the extracted humid indoor air. If the condensed water changes to ice in the heat exchanger, the airflow rate will quickly fall due to the increasing pressure...... problem is therefore desirable. In this paper, the construction and test measurements of a new counter flow heat exchanger designed for cold climates are presented. The developed heat exchanger is capable of continuously defrosting itself without using supplementary heating. Other advantages...... of the developed beat exchanger are low pressure loss, cheap materials and a simple construction. The disadvantage is that the exchanger is big compared with other heat exchangers. In this paper, the new heat exchanger's efficiency is calculated theoretically and measured experimentally. The experiment shows...

  20. The Usage of Informational Gateways for Data Exchange between Personal Data Systems of Different Classes

    Directory of Open Access Journals (Sweden)

    E. I. Goncharov

    2010-03-01

    Full Text Available When personal data exchange between informational systems takes place, one must guarantee the systems are not integrating but just interacting. This task can not be accomplished by using traditional tools such as firewalls, cryptography and so on. To solve the problem we suggest deploying of informational gateway in personal data exchange process.

  1. Development of a contact heat exchanger for a constructable radiator system

    Science.gov (United States)

    Howell, H. R.

    1983-01-01

    A development program for a contact heat exchanger to be used to transfer heat from a spacecraft coolant loop to a heat pipe radiator is described. The contact heat exchanger provides for a connectable/disconnectable joint which allows for on-orbit assembly of the radiator system and replacement or exchange of radiator panels for repair and maintenance. The contact heat exchanger does not require the transfer of fluid across the joint; the spacecraft coolant loop remains contained in an all welded system with no static or dynamic fluid seals. The contact interface is also "dry' with no conductive grease or interstitial material required.

  2. Large scale free energy calculations for blind predictions of protein-ligand binding: the D3R Grand Challenge 2015.

    Science.gov (United States)

    Deng, Nanjie; Flynn, William F; Xia, Junchao; Vijayan, R S K; Zhang, Baofeng; He, Peng; Mentes, Ahmet; Gallicchio, Emilio; Levy, Ronald M

    2016-09-01

    We describe binding free energy calculations in the D3R Grand Challenge 2015 for blind prediction of the binding affinities of 180 ligands to Hsp90. The present D3R challenge was built around experimental datasets involving Heat shock protein (Hsp) 90, an ATP-dependent molecular chaperone which is an important anticancer drug target. The Hsp90 ATP binding site is known to be a challenging target for accurate calculations of ligand binding affinities because of the ligand-dependent conformational changes in the binding site, the presence of ordered waters and the broad chemical diversity of ligands that can bind at this site. Our primary focus here is to distinguish binders from nonbinders. Large scale absolute binding free energy calculations that cover over 3000 protein-ligand complexes were performed using the BEDAM method starting from docked structures generated by Glide docking. Although the ligand dataset in this study resembles an intermediate to late stage lead optimization project while the BEDAM method is mainly developed for early stage virtual screening of hit molecules, the BEDAM binding free energy scoring has resulted in a moderate enrichment of ligand screening against this challenging drug target. Results show that, using a statistical mechanics based free energy method like BEDAM starting from docked poses offers better enrichment than classical docking scoring functions and rescoring methods like Prime MM-GBSA for the Hsp90 data set in this blind challenge. Importantly, among the three methods tested here, only the mean value of the BEDAM binding free energy scores is able to separate the large group of binders from the small group of nonbinders with a gap of 2.4 kcal/mol. None of the three methods that we have tested provided accurate ranking of the affinities of the 147 active compounds. We discuss the possible sources of errors in the binding free energy calculations. The study suggests that BEDAM can be used strategically to discriminate

  3. Leak detection in a high-pressure heat exchanger system in a refinery using radiotracer technique

    International Nuclear Information System (INIS)

    Samantray, J.S.; Sunil Goswami; Sharma, V.K.; Jayashree Biswal; Pant, H.J.

    2014-01-01

    A radiotracer investigation was carried out in a diesel hydrotreater (DHDT) unit in a refinery for leak detection in a breech-lock heat exchanger system. The main objectives of the study were to identify the leaking heat exchanger in a system with six heat exchangers and estimate the leak rate. Bromine-82 as dibromobiphenyl was selected and used as radiotracer for the investigation. The radiotracer was instantaneously injected into the suction end of the feed pump line to the heat exchanger of the DHDT unit. The movement of the tracer was measured at strategically selected locations using NaI(Tl) scintillation detectors. Based upon the results of the radiotracer investigation, it was found that out of six heat exchangers, exchanger E-1F was leaking. (author)

  4. Effects and Implications for Adoption of Brokerage System in Korea's Foreign Exchange Market

    Directory of Open Access Journals (Sweden)

    Yunjong Wang

    1999-03-01

    Full Text Available Since January 1st 1999, the South Korean government has begun to establish the understructure of the foreign exchange market in order to achieve the liberalization of foreign exchange. As one of the plans, the trade of foreign exchange which was under the monopolized mediation of the capital medium of financial settlement center will be in the charge of several commercial brokers. In the developed countries, the foreign exchange & stock system and the liberalization of foreign exchange are both widely used in a flexible way. So it is predicted that the introduction of commercial foreign exchange & stock system will bring positive effect to the enhancement of the market efficiency and the function of price both in South Korean market and overseas market, the foster of competitive power of the domestic broker and the improvement of the understructure of domestic foreign exchange market. But more importantly is that the foreign exchange market must expand the scale of its participator, bring in various relevant foreign exchange products and develop the bond market which has a close relationship with the foreign exchange market for further development.

  5. Inverse Problem and Variation Method to Optimize Cascade Heat Exchange Network in Central Heating System

    Institute of Scientific and Technical Information of China (English)

    ZHANG Yin; WEI Zhiyuan; ZHANG Yinping; WANG Xin

    2017-01-01

    Urban heating in northern China accounts for 40% of total building energy usage.In central heating systems,heat is often transfened from heat source to users by the heat network where several heat exchangers arc installed at heat source,substations and terminals respectively.For given overall heating capacity and heat source temperarure,increasing the terminal fluid temperature is an effective way to improve the thermal performance of such cascade heat exchange network for energy saving.In this paper,the mathematical optimization model of the cascade heat exchange network with three-stage heat exchangers in series is established.Aim at maximizing the cold fluid temperature for given hot fluid temperature and overall heating capacity,the optimal heat exchange area distribution and the medium fluids' flow rates are determined through inverse problem and variation method.The preliminary results show that the heat exchange areas should be distributed equally for each heat exchanger.It also indicates that in order to improve the thernmal performance of the whole system,more heat exchange areas should be allocated to the heat exchanger where flow rate difference between two fluids is relatively small.This work is important for guiding the optimization design of practical cascade heating systems.

  6. Heat pipe heat exchangers in heat recovery systems

    Energy Technology Data Exchange (ETDEWEB)

    Stulc, P; Vasiliev, L L; Kiseljev, V G; Matvejev, Ju N

    1985-01-01

    The results of combined research and development activities of the National Research Institute for Machine Design, Prague, C.S.S.R. and the Institute for Heat and Mass Transfer, Minsk, U.S.S.R. concerning intensification heat pipes used in heat pipe heat exchangers are presented. This sort of research has been occasioned by increased interest in heat power economy trying to utilise waste heat produced by various technological processes. The developed heat pipes are deployed in construction of air-air, gas-air or gas-gas heat recovery exchangers in the field of air-engineering and air-conditioning. (author).

  7. Investigation of Condensation Heat Transfer Correlation of Heat Exchanger Design in Secondary Passive Cooling System

    Energy Technology Data Exchange (ETDEWEB)

    Ju, Yun Jae; Lee, Hee Joon [Kookmin Univ., Seoul (Korea, Republic of); Kang, Hanok; Lee, Taeho; Park, Cheontae [Korea Atomic Energy Research Institute, Daejeon (Korea, Republic of)

    2013-12-15

    Recently, condensation heat exchangers have been studied for applications to the passive cooling systems of nuclear plants. To design vertical-type condensation heat exchangers in secondary passive cooling systems, TSCON (Thermal Sizing of CONdenser), a thermal sizing program for a condensation heat exchanger, was developed at KAERI (Korea Atomic Energy Research Institute). In this study, the existing condensation heat transfer correlation of TSCON was evaluated using 1,157 collected experimental data points from the heat exchanger of a secondary passive cooling system for the case of pure steam condensation. The investigation showed that the Shah correlation, published in 2009, provided the most satisfactory results for the heat transfer coefficient with a mean absolute error of 34.8%. It is suggested that the Shah correlation is appropriate for designing a condensation heat exchanger in TSCON.

  8. Magneto-structural correlations in exchange coupled systems

    International Nuclear Information System (INIS)

    Willett, R.D.; Gatteschi, D.; Kahn, O.

    1985-01-01

    This book contains 19 chapters. Some of the chapter titles are: Optical Spectroscophy; The Basis of Spin-Hamiltonian Theory; Inelastic Neutorn Scattering From Clusters; Magneto-structural Correlations in Bioinorganic Chemistry; and Magnetic Exchange Interactions Propagated by Multi-Atom Bridges

  9. Switching behaviour of coupled antiferro- and ferromagnetic systems: exchange bias

    DEFF Research Database (Denmark)

    Lindgård, Per-Anker

    2009-01-01

    in NiO nanoparticles (Kodama and Berkowitz 1999 Phys. Rev. B 59 6321 and Lindgård 2003 J. Magn. Magn. Mater. 266 88)) in a field severely limits the exchange biasing potential. The interface between the different magnets is found to be that originally assumed by Meiklejohn and Bean (1956 Phys. Rev. 102...

  10. Development of a Malian food exchange system based on local ...

    African Journals Online (AJOL)

    No significant differences were found for the intakes of legumes, milk, vegetables and sugar-added foods. Conclusions: This study allowed the development of Malian food exchange lists and demonstrated their usefulness for the description of the dietary pattern and energy and macronutrient intakes of male and female ...

  11. Repair systems with exchangeable items and the longest queue mechanism

    NARCIS (Netherlands)

    Ravid, R.; Boxma, O.J.; Perry, D.

    2013-01-01

    We consider a repair facility consisting of one repairman and two arrival streams of failed items, from bases 1 and 2. The arrival processes are independent Poisson processes, and the repair times are independent and identically exponentially distributed. The item types are exchangeable, and a

  12. Repair systems with exchangeable items and the longest queue mechanism

    NARCIS (Netherlands)

    Ravid, R.; Boxma, O.J.; Perry, D.

    2011-01-01

    We consider a repair facility consisting of one repairman and two arrival streams of failed items, from bases 1 and 2. The arrival processes are independent Poisson processes, and the repair times are independent and identically exponentially distributed. The item types are exchangeable, and a

  13. Optimization of the Heat Exchangers of a Thermoelectric Generation System

    Science.gov (United States)

    Martínez, A.; Vián, J. G.; Astrain, D.; Rodríguez, A.; Berrio, I.

    2010-09-01

    The thermal resistances of the heat exchangers have a strong influence on the electric power produced by a thermoelectric generator. In this work, the heat exchangers of a thermoelectric generator have been optimized in order to maximize the electric power generated. This thermoelectric generator harnesses heat from the exhaust gas of a domestic gas boiler. Statistical design of experiments was used to assess the influence of five factors on both the electric power generated and the pressure drop in the chimney: height of the generator, number of modules per meter of generator height, length of the fins of the hot-side heat exchanger (HSHE), length of the gap between fins of the HSHE, and base thickness of the HSHE. The electric power has been calculated using a computational model, whereas Fluent computational fluid dynamics (CFD) has been used to obtain the thermal resistances of the heat exchangers and the pressure drop. Finally, the thermoelectric generator has been optimized, taking into account the restrictions on the pressure drop.

  14. Acetylcholinesterase complexed with bivalent ligands related to huperzine a: experimental evidence for species-dependent protein-ligand complementarity.

    Science.gov (United States)

    Wong, Dawn M; Greenblatt, Harry M; Dvir, Hay; Carlier, Paul R; Han, Yi-Fan; Pang, Yuan-Ping; Silman, Israel; Sussman, Joel L

    2003-01-15

    active-site gorge explain the switch in inhibitory potency of (-)-2a and 2b and the larger dimer/(-)-HupA potency ratios observed for TcAChE relative to rat AChE. The results offer new insights into factors affecting protein-ligand complementarity within the gorge and should assist the further development of improved AChE inhibitors.

  15. Triangularly arranged heat exchanger bundles to restrain wind effects on natural draft dry cooling system

    International Nuclear Information System (INIS)

    Liao, H.T.; Yang, L.J.; Du, X.Z.; Yang, Y.P.

    2016-01-01

    Highlights: • Triangularly arranged heat exchanger around the dry-cooling tower is proposed. • By coupling condenser with dry cooling system, TACHE performance is obtained. • At low wind speeds, cooling performance with TACHE is inferior to that with CACHE. • Better performance can be achieved for cooling system with TACHE at high wind speeds. • TACHE can be applied to the region with the strong prevailing wind all year around. - Abstract: It has been commonly recognized that the crosswind may deteriorate the cooling performance of the natural draft dry cooling system with vertically arranged heat exchanger bundles around the circumference of dry-cooling tower. With the purpose for restraining the adverse effects of ambient winds, a novel triangular configuration of heat exchanger bundles is proposed in this work. The air-side flow and heat transfer models coupled with the circulating water heat transfer process are developed for two kinds of natural draft dry cooling systems with the conventional circularly arranged and novel triangularly arranged heat exchanger bundles, by which the flow and temperature fields, mass flow rate of cooling air, outlet water temperature of heat exchanger and turbine back pressure are obtained. Three wind directions of 0°, 90°, and 180° are investigated at various wind speeds for the natural draft dry cooling system with triangularly arranged heat exchanger bundles, which are compared with the conventional system with circularly arranged heat exchanger bundles. The results show that the thermo-flow performances of the natural draft dry cooling system with triangularly arranged heat exchanger get improved significantly at high wind speeds and in the wind direction of 180°, thus a low turbine back pressure can be achieved, which is of benefit to the energy efficiency of the power generating unit. The natural draft dry cooling system with triangularly arranged heat exchanger is recommended to apply to the regions with

  16. Theoretical evaluation on the impact of heat exchanger in Advanced Adiabatic Compressed Air Energy Storage system

    International Nuclear Information System (INIS)

    Yang, Ke; Zhang, Yuan; Li, Xuemei; Xu, Jianzhong

    2014-01-01

    Highlights: • A multi-stage AA-CAES system model is established based on thermodynamic theory. • Four Cases about pressure loss and effectiveness of heat exchanger are investigated. • The impact of pressure loss on conversion of heat energy in TES is more sensitive. • The impact of heat exchanger effectiveness in charge process on system is stronger. • Pressure loss in heat exchanger affects the change trends of system efficiency. - Abstract: Advanced Adiabatic Compressed Air Energy Storage (AA-CAES) is a large-scale energy storage system based on gas turbine technology and thermal energy storage (TES). Electrical energy can be converted into internal energy of air and heat energy in TES during the charge process, while reverse energy conversion proceeds during discharge process. The performance of AA-CAES system requires further improvement in order to increase efficiency. In this paper, a multi-stage AA-CAES system model is established, and the influence of effectiveness and pressure loss in heat exchanger on energy conversion and utilization efficiency of AA-CAES system is analyzed theoretically based on the theory of thermodynamics. Four Cases about effectiveness and pressure loss of heat exchanger are investigated and compared with each other. It is found that effectiveness and pressure loss of heat exchanger are directly related to energy conversion and utilization in AA-CAES system. System efficiency changes with the variation of heat exchanger effectiveness and the impact of pressure loss on conversion of heat energy in TES is more sensitive than that of internal energy of air. Pressure loss can cause the complexity of system efficiency change. With appropriate selection of the values of heat exchanger effectiveness for both charge and discharge processes, an AA-CAES system with a higher efficiency could be expected

  17. EXFOR systems manual: Nuclear reaction data exchange format

    International Nuclear Information System (INIS)

    McLane, V.

    1996-07-01

    This document describes EXFOR, the exchange format designed to allow transmission of nuclear reaction data between the members of the Nuclear Data Centers Network. In addition to storing the data and its bibliographic information, experimental information, including source of uncertainties, is also compiled. The status and history of the data set is also included, e.g., the source of the data, any updates which have been made, and correlations to other data sets. The exchange format, as outlined, is designed to allow a large variety of numerical data tables with explanatory and bibliographic information to be transmitted in an easily machine-readable format (for checking and indicating possible errors) and a format that can be read by personnel (for passing judgment on and correcting any errors indicated by the machine)

  18. EXFOR Systems Manual Nuclear reaction Data Exchange Format

    International Nuclear Information System (INIS)

    McLane, V.

    2000-01-01

    EXFOR is an exchange format designed to allow transmission of nuclear reaction data between the members of the Nuclear Data Centers Network. This document has been written for use by the members of the Network and includes matters of procedure and protocol, as well as detailed rules for the compilation of data. Users may prefer to consult EXFOR Basics' for a brief description of the format

  19. EXFOR SYSTEMS MANUAL NUCLEAR REACTION DATA EXCHANGE FORMAT.

    Energy Technology Data Exchange (ETDEWEB)

    MCLANE,V.; NUCLEAR DATA CENTER NETWORK

    2000-05-19

    EXFOR is an exchange format designed to allow transmission of nuclear reaction data between the members of the Nuclear Data Centers Network. This document has been written for use by the members of the Network and includes matters of procedure and protocol, as well as detailed rules for the compilation of data. Users may prefer to consult EXFOR Basics' for a brief description of the format.

  20. Exchange rate system and policy in the present world

    OpenAIRE

    Grubišić Zoran

    2005-01-01

    The choice of exchange rate regime is important, not only in terms of its effect on trade flows, but also with respect to inflation expectations. Countries facing disinflation may find that pegs regimes are more appropriate solution. But where the trade balance account is significantly deteriorated and growth has been sluggish, a more flexible regime might be called for. The natural classification in eighties and early nineties suggests that intermediate regimes may provide important advantag...

  1. Exchange rate system and policy in the present world

    Directory of Open Access Journals (Sweden)

    Grubišić Zoran

    2005-01-01

    Full Text Available The choice of exchange rate regime is important, not only in terms of its effect on trade flows, but also with respect to inflation expectations. Countries facing disinflation may find that pegs regimes are more appropriate solution. But where the trade balance account is significantly deteriorated and growth has been sluggish, a more flexible regime might be called for. The natural classification in eighties and early nineties suggests that intermediate regimes may provide important advantages – to capture some of the benefits of both extremes while avoiding many of the costs. However today many experts predicted that exchange rate regimes would move in a "bipolar" manner to the extremes of "hard" pegs or free floats. An increasing number of countries did announce their intent to allow greater exchange rate flexibility. But, in practice, countries had a "fear of floating ". Distinction is made among advanced, emerging and other developing countries. Emerging markets have stronger links to international capital markets than do other developing economies. Thus, while non-emerging market developing economies may gain credibility through pegging their exchange rates, emerging markets find it harder to do so and could benefit from investing in "learning to float". More advanced economies with their access to international capital market are best positioned to enjoy the benefits of flexibility. It is found that the proportion of countries adopting intermediate regimes has indeed been shrinking in favor of greater flexibility or greater fixity, especially for countries more integrated with international markets. But, there is no final conclusion on the idea that intermediate regimes will dissapear.

  2. Brief Report: Randomized Test of the Efficacy of Picture Exchange Communication System on Highly Generalized Picture Exchanges in Children with ASD

    OpenAIRE

    Yoder, Paul J.; Lieberman, Rebecca G.

    2010-01-01

    A randomized control trial comparing two social-communication interventions in young children with autism examined far-transfer of the use of picture exchange to communicate. Thirty-six children were randomly assigned to one of two treatment conditions, one of which was the Picture Exchange Communication System (PECS). All children had access to picture symbols during assessments. Post-treatment measurement of the number of picture exchanges in a far-transfer, assessment context favored the P...

  3. Replica exchange with solute tempering: A method for sampling biological systems in explicit water

    Science.gov (United States)

    Liu, Pu; Kim, Byungchan; Friesner, Richard A.; Berne, B. J.

    2005-09-01

    An innovative replica exchange (parallel tempering) method called replica exchange with solute tempering (REST) for the efficient sampling of aqueous protein solutions is presented here. The method bypasses the poor scaling with system size of standard replica exchange and thus reduces the number of replicas (parallel processes) that must be used. This reduction is accomplished by deforming the Hamiltonian function for each replica in such a way that the acceptance probability for the exchange of replica configurations does not depend on the number of explicit water molecules in the system. For proof of concept, REST is compared with standard replica exchange for an alanine dipeptide molecule in water. The comparisons confirm that REST greatly reduces the number of CPUs required by regular replica exchange and increases the sampling efficiency. This method reduces the CPU time required for calculating thermodynamic averages and for the ab initio folding of proteins in explicit water. Author contributions: B.J.B. designed research; P.L. and B.K. performed research; P.L. and B.K. analyzed data; and P.L., B.K., R.A.F., and B.J.B. wrote the paper.Abbreviations: REST, replica exchange with solute tempering; REM, replica exchange method; MD, molecular dynamics.*P.L. and B.K. contributed equally to this work.

  4. Evaluating humidity recovery efficiency of currently available heat and moisture exchangers: a respiratory system model study

    Directory of Open Access Journals (Sweden)

    Jeanette Janaina Jaber Lucato

    2009-06-01

    Full Text Available OBJECTIVES: To evaluate and compare the efficiency of humidification in available heat and moisture exchanger models under conditions of varying tidal volume, respiratory rate, and flow rate. INTRODUCTION: Inspired gases are routinely preconditioned by heat and moisture exchangers to provide a heat and water content similar to that provided normally by the nose and upper airways. The absolute humidity of air retrieved from and returned to the ventilated patient is an important measurable outcome of the heat and moisture exchangers' humidifying performance. METHODS: Eight different heat and moisture exchangers were studied using a respiratory system analog. The system included a heated chamber (acrylic glass, maintained at 37°C, a preserved swine lung, a hygrometer, circuitry and a ventilator. Humidity and temperature levels were measured using eight distinct interposed heat and moisture exchangers given different tidal volumes, respiratory frequencies and flow-rate conditions. Recovery of absolute humidity (%RAH was calculated for each setting. RESULTS: Increasing tidal volumes led to a reduction in %RAH for all heat and moisture exchangers while no significant effect was demonstrated in the context of varying respiratory rate or inspiratory flow. CONCLUSIONS: Our data indicate that heat and moisture exchangers are more efficient when used with low tidal volume ventilation. The roles of flow and respiratory rate were of lesser importance, suggesting that their adjustment has a less significant effect on the performance of heat and moisture exchangers.

  5. High Throughput, Label-free Screening Small Molecule Compound Libraries for Protein-Ligands using Combination of Small Molecule Microarrays and a Special Ellipsometry-based Optical Scanner.

    Science.gov (United States)

    Landry, James P; Fei, Yiyan; Zhu, X D

    2011-12-01

    Small-molecule compounds remain the major source of therapeutic and preventative drugs. Developing new drugs against a protein target often requires screening large collections of compounds with diverse structures for ligands or ligand fragments that exhibit sufficiently affinity and desirable inhibition effect on the target before further optimization and development. Since the number of small molecule compounds is large, high-throughput screening (HTS) methods are needed. Small-molecule microarrays (SMM) on a solid support in combination with a suitable binding assay form a viable HTS platform. We demonstrate that by combining an oblique-incidence reflectivity difference optical scanner with SMM we can screen 10,000 small-molecule compounds on a single glass slide for protein ligands without fluorescence labeling. Furthermore using such a label-free assay platform we can simultaneously acquire binding curves of a solution-phase protein to over 10,000 immobilized compounds, thus enabling full characterization of protein-ligand interactions over a wide range of affinity constants.

  6. Combined quantum mechanics/molecular mechanics (QM/MM) simulations for protein-ligand complexes: free energies of binding of water molecules in influenza neuraminidase.

    Science.gov (United States)

    Woods, Christopher J; Shaw, Katherine E; Mulholland, Adrian J

    2015-01-22

    The applicability of combined quantum mechanics/molecular mechanics (QM/MM) methods for the calculation of absolute binding free energies of conserved water molecules in protein/ligand complexes is demonstrated. Here, we apply QM/MM Monte Carlo simulations to investigate binding of water molecules to influenza neuraminidase. We investigate five different complexes, including those with the drugs oseltamivir and peramivir. We investigate water molecules in two different environments, one more hydrophobic and one hydrophilic. We calculate the free-energy change for perturbation of a QM to MM representation of the bound water molecule. The calculations are performed at the BLYP/aVDZ (QM) and TIP4P (MM) levels of theory, which we have previously demonstrated to be consistent with one another for QM/MM modeling. The results show that the QM to MM perturbation is significant in both environments (greater than 1 kcal mol(-1)) and larger in the more hydrophilic site. Comparison with the same perturbation in bulk water shows that this makes a contribution to binding. The results quantify how electronic polarization differences in different environments affect binding affinity and also demonstrate that extensive, converged QM/MM free-energy simulations, with good levels of QM theory, are now practical for protein/ligand complexes.

  7. Data Description Exchange Services for Heterogeneous Vehicle and Spaceport Control and Monitor Systems, Phase I

    Data.gov (United States)

    National Aeronautics and Space Administration — CCT proposes an advanced data description exchange approach for space/spaceport systems that will provide a generic platform independent software capability for...

  8. RRB's SVES Input File - Post Entitlement State Verification and Exchange System (PSSVES)

    Data.gov (United States)

    Social Security Administration — Several PSSVES request files are transmitted to SSA each year for processing in the State Verification and Exchange System (SVES). This is a first step in obtaining...

  9. Gain measurements of the Ca-Xe charge exchange system. [for UV lasers

    Science.gov (United States)

    Michels, C. J.; Chubb, D. L.

    1978-01-01

    Charge-exchange-pumped Ca(+) was studied for possible positive laser gain at 370.6 and 315.9 nm using an Xe MPD arc as the Xe(+) source. The present paper describes the MPD arc, the calcium injection system, the diagnostics for gain, and spontaneous emission measurements and results. No positive gain measurements were observed. A small Xe-Ca charge exchange cross section compared to He-metal laser systems charge exchange cross sections is the most probable reason why the result was negative.

  10. Experience with Floating Interbank Exchange Rate Systems in Five Developing Economies

    OpenAIRE

    Vicente Galbis

    1993-01-01

    This paper reviews the experience with floating interbank exchange rate systems in five developing countries--The Gambia, Guyana, Jamaica, Nigeria and Sri Lanka--and draws some conclusions about the stability and efficiency of these systems. The experience of these countries illustrates both the difficulties and the advantages of interbank exchange rate markets. The main conclusion is that these markets can operate relatively well with a minimum banking infrastructure, provided that the autho...

  11. Enthalpy analysis and Heat Exchanger Sizing of an Air-cooled Proton Exchange Membrane Fuel Cell System

    DEFF Research Database (Denmark)

    Gao, Xin; Berning, Torsten; Kær, Søren Knudsen

    below -20 °C in the winter which make liquid-cooled fuel cells impossible. In such cases, air-cooled fuel cell systems are deployed where the air that is fed to the fuel cell serves both as reactant supplier and coolant to remove the waste heat that is generated during fuel cell operation. In some cases...... in order to optimize the operating conditions and the performance of such a system. The adjustable parameters include the fan speed that determines the amount of air that is brought into the system, and the size and rotating speed of the rotating enthalpy wheel. In addition, computational fluid dynamics...... or an ordinary heat exchanger can fulfill the heat recovery demand. Despite the fact that the air enters the stack at a cold temperature, even the forefront of the stack is at a much elevated and desired stack temperature with the help of supplying an acceptable amount of power to an electric stack heater. So...

  12. Dynamic analysis of complex tube systems in heat exchangers

    International Nuclear Information System (INIS)

    Kouba, J.; Dvorak, P.

    1985-01-01

    Using a computation model, a dynamic analysis was made of tube assemblies of heat exchanger bundles by the finite element method. The algorithm is presented for determining the frequency mode properties, based on the Sturm sequences combined with inverse vector iteration. The results obtained using the method are compared with those obtained by analytical solution and by the transfer matrix method, this for the cases of both eigenvibrations and resonance vibrations. The results are in very good agreement. For the first four eigenfrequencies, the calculation error is less than 1.5% as against the analytical solution. (J.B.). 4 tabs., 8 figs., 5 refs

  13. A study of model systems in anionic exchange

    International Nuclear Information System (INIS)

    Haegele, R.; Boeyens, J.C.A.

    1977-01-01

    Preliminary experiments are reported on the preparation and characterization of anionic sulphate and chloride complexes of UO 2+ 2 and iron(III), benzyl-trimethylammonium cation being used as a model substance for the simulation of positive sites in an anionic-exchange resin. The structure of (BTMA) 4 [UO 2 CL 3 -O 2 -CL 3 UO 2 ], a binuclear uranyl-peroxocomplex that has not been reported in the literature, was elucidated by single-crystal x-ray examination, and is described and discussed [af

  14. Switching behaviour of coupled antiferro- and ferromagnetic systems: exchange bias

    Energy Technology Data Exchange (ETDEWEB)

    Lindgaard, Per-Anker [Materials Research Division, Risoe National Laboratory for Sustainable Energy, Danish Technical University, DK-4000 Roskilde (Denmark)

    2009-11-25

    The switching behaviour, under reversal of an external field, of a simple, ideal magnetic nanoparticle is studied and the interplay between antiferromagnets and ferromagnets elucidated. It is found that the switching between various multi- q ordering in fcc antiferromagnets (as found theoretically in NiO nanoparticles (Kodama and Berkowitz 1999 Phys. Rev. B 59 6321 and Lindgaard 2003 J. Magn. Magn. Mater. 266 88)) in a field severely limits the exchange biasing potential. The interface between the different magnets is found to be that originally assumed by Meiklejohn and Bean (1956 Phys. Rev. 102 1413).

  15. Control and prevention of ice formation and accretion on heat exchangers for ventilation systems

    DEFF Research Database (Denmark)

    Rahimi, Maral; Afshari, Alireza

    2015-01-01

    In cold climates, the application of mechanical ventilation systems with heat recovery like are airto-air exchangers is used for reducing energy consumption for heating buildings by transferring heat exhausted air to supply air. However, increase efficiency of heat exchanger results in lower...... exhaust air temperatures and Ice formation on heat exchanger fins, which can cause problem and is not favourable. Therefore, prevention and control of ice formation on heat exchangers is necessary. The existing methods are divided into two different methods: active and passive ice control methods....... The active methods are e.g. bypass, recirculation, preheating. The passive methods relate to the surface characteristics of the heat exchanger fins as they have effect on ice formation in initial phase. All these methods have varying levels of success, cost, and effectiveness, which are depending on the heat...

  16. Brief Report: Randomized Test of the Efficacy of Picture Exchange Communication System on Highly Generalized Picture Exchanges in Children with ASD

    Science.gov (United States)

    Yoder, Paul J.; Lieberman, Rebecca G.

    2010-01-01

    A randomized control trial comparing two social-communication interventions in young children with autism examined far-transfer of the use of picture exchange to communicate. Thirty-six children were randomly assigned to one of two treatment conditions, one of which was the Picture Exchange Communication System (PECS). All children had access to…

  17. New system applying image processor to automatically separate cation exchange resin and anion exchange resin for condensate demineralizer

    International Nuclear Information System (INIS)

    Adachi, Tsuneyasu; Nagao, Nobuaki; Yoshimori, Yasuhide; Inoue, Takashi; Yoda, Shuji

    2014-01-01

    In PWR plant, condensate demineralizer is equipped to remove corrosive ion in condensate water. Mixed bed packing cation exchange resin (CER) and anion exchange resin (AER) is generally applied, and these are regenerated after separation to each layer periodically. Since the AER particle is slightly lighter than the CER particle, the AER layer is brought up onto the CER layer by feeding water upward from the bottom of column (backwashing). The separation performance is affected by flow rate and temperature of water for backwashing, so normally operators set the proper condition parameters regarding separation manually every time for regeneration. The authors have developed the new separation system applying CCD camera and image processor. The system is comprised of CCD camera, LED lamp, image processor, controller, flow control valves and background color panel. Blue color of the panel, which is corresponding to the complementary color against both ivory color of AER and brown color of CER, is key to secure the system precision. At first the color image of the CER via the CCD camera is digitized and memorized by the image processor. The color of CER in the field of vision of the camera is scanned by the image processor, and the position where the maximum difference of digitized color index is indicated is judged as the interface. The detected interface is able to make the accordance with the set point by adjusting the flow rate of backwashing. By adopting the blue background panel, it is also possible to draw the AER out of the column since detecting the interface of the CER clearly. The system has provided the reduction of instability factor concerning separation of resin during regeneration process. The system has been adopted in two PWR plants in Japan, it has been demonstrating its stable and precise performance. (author)

  18. Evaluating the Uncertainty in Exchange Parameters Determined from Off-Resonance R1ρ Relaxation Dispersion for Systems in Fast Exchange

    Science.gov (United States)

    Bothe, Jameson R.; Stein, Zachary W.; Al-Hashimi, Hashim M.

    2014-01-01

    Spin relaxation in the rotating frame (R1ρ) is a powerful NMR technique for characterizing fast microsecond timescale exchange processes directed toward short-lived excited states in biomolecules. At the limit of fast exchange, only kex = k1 + k−1 and Φıx = pGpE(Δω)2 can be determined from R1ρ data limiting the ability to characterize the structure and energetics of the excited state conformation. Here, we use simulations to examine the uncertainty with which exchange parameters can be determined for two state systems in intermediate-to-fast exchange using off-resonance R1ρ relaxation dispersion. R1ρ data computed by solving the Bloch-McConnell equations reveals small but significant asymmetry with respect to offset (R1ρ(ΔΩ) ≠ R1ρ(−ΔΩ)), which is a hallmark of slow-to-intermediate exchange, even under conditions of fast exchange for free precession chemical exchange line broadening (kex/Δω > 10). A grid search analysis combined with bootstrap and Monte-Carlo based statistical approaches for estimating uncertainty in exchange parameters reveals that both the sign and magnitude of Δω can be determined at a useful level of uncertainty for systems in fast exchange (kex/Δω exchange parameters. Results from simulations are complemented by analysis of experimental R1ρ data measured in three nucleic acid systems with exchange processes occurring on the slow (kex/Δω = 0.2; pE = ~ 0.7%), fast (kex/Δω = ~10–16; pE = ~13%) and very fast (kex = 39,000 s−1) chemical shift timescales. PMID:24819426

  19. Characterization of protein/ligand interactions by 1H/3H exchange: application to the hAsf1/ histone H3 complex

    International Nuclear Information System (INIS)

    Mousseau, G.

    2007-05-01

    In the first chapter will be exposed the main current methods of identification to high debit of the interactions protein-protein. Then the methods allowing to characterize the surfaces of interaction or to determine the structures of the complexes will be listed by discussing the main advantages and the inconveniences. Our approach of characterization of the zones of interaction protein-protein is a method of 'foot-printing' 1, based on the identification and radicals' quantification formed on the residues of proteins accessible to the water. The second chapter will so discuss the development of this method of radical identification using the atom of tritium as radioactive label. Our approach will finally be validated in the third chapter by applying it to the characterization of amino acids involved in the interaction enter the human protein anti silencing factor 1 (hAsf11-156) and a fragment of the histone H 3 . (N.C.)

  20. Real time alert system: a disease management system leveraging health information exchange.

    Science.gov (United States)

    Anand, Vibha; Sheley, Meena E; Xu, Shawn; Downs, Stephen M

    2012-01-01

    Rates of preventive and disease management services can be improved by providing automated alerts and reminders to primary care providers (PCPs) using of health information technology (HIT) tools. Using Adaptive Turnaround Documents (ATAD), an existing Health Information Exchange (HIE) infrastructure and office fax machines, we developed a Real Time Alert (RTA) system. RTA is a computerized decision support system (CDSS) that is able to deliver alerts to PCPs statewide for recommended services around the time of the patient visit. RTA is also able to capture structured clinical data from providers using existing fax technology. In this study, we evaluate RTA's performance for alerting PCPs when their patients with asthma have an emergency room visit anywhere in the state. Our results show that RTA was successfully able to deliver "just in time" patient-relevant alerts to PCPs across the state. Furthermore, of those ATADs faxed back and automatically interpreted by the RTA system, 35% reported finding the provided information helpful. The PCPs who reported finding information helpful also reported making a phone call, sending a letter or seeing the patient for follow up care. We have successfully demonstrated the feasibility of electronically exchanging important patient related information with the PCPs statewide. This is despite a lack of a link with their electronic health records. We have shown that using our ATAD technology, a PCP can be notified quickly of an important event such as a patient's asthma related emergency room admission so further follow up can happen in near real time.

  1. Kinetics of isotope exchange reactions involving intra- and intermolecular reactions: 1. Rate law for a system with two chemical compounds and three exchangeable atoms

    International Nuclear Information System (INIS)

    Xuelei Chu; Ohmoto, Hiroshi

    1991-01-01

    For an isotopic exchange reaction between two compounds (X and AB) in a homogeneous system, such as a gaseous or aqueous system, where one (AB) of them possesses two exchangeable atoms in non-equivalent positions and where one intramolecular isotope exchange (A ↔ B) and two intermolecular isotope exchange reactions (X ↔ A and X ↔ B) may occur, its rate law no longer obeys a pseudo-first order rate equation described for simple two-component systems by many previous investigators. The change with time of the δ value of each of the three components (X, A, and B) in a closed and homogeneous system is a complicated function of the initial δ values of the three components, the chemical concentrations of the two compounds, and the overall rate constants of the forward and reverse reactions involving the two intermolecular and one intramolecular reactions of isotope exchanges. Also, for some one of the three components, the change of its δ value with time may not be monotonic, and the relationship of 1n (1 - F) with time may be non-linear in a plot of 1n (1 - F) vs. t. In addition, the rate law of the isotope exchange reaction in this system also provides a quantitative method to estimate the overall rate constants for the one-intra-and two intermolecular isotope exchanges and the equilibrium isotopic fractionation factors among the three components

  2. Exchange reactions in the systems of alkali metal, silver and thallium, sulfates, niobates and tantalates

    International Nuclear Information System (INIS)

    Belyaev, I.N.; Lupejko, T.G.; Nalbandyan, V.B.; Abanina, E.V.

    1978-01-01

    Investigated are exchange interactions in diagonal cross sections of twenty triple mutual systems with A and A' cations and SO 4 and MO 3 anions where A and A'-Li, Na, K, Ag, Tl, M-Nb, Ta using the methods of X-ray phase, chemical and differential thermal analyses. Exchange reaction between crystal complex oxide and melted salt are effective synthesis method. These reactions in particular permitted to obtain pure AgNbO 3 , AgTaO 3 and their solid solutions at temperatures hundreds degrees lower than in displacement reactions. Equilibrium samples of AMO 3 -A'MO 3 systems, continuous or discontinuous solid solutions, compounds (except NaMO 3 -KMO 3 , and also LiTaO 3 -KTaO 3 ) are formed in exchange reactions when there is sulfate shortage. Thus, exchange reactions can be applied for solid solution synthesis, and also for phase diagram study

  3. Development of a control system for shell and tube heat exchanger in Matlab simulink

    International Nuclear Information System (INIS)

    Zeeshan, H.M.

    2014-01-01

    The main objective of this research is to develop a control system for heat exchanger so that the desired outlet temperature can be achieved by controlling the flow rate. For this purpose, shell and tube heat exchanger was chosen and modeled it by using its mathematical equations in MATLAB (Matrix Laboratory) Simulink and calculated the outlet temperature by NTU (Number of Transfer Units) effectiveness method. For the purpose of Control system, MPC (Model Predictive Controller) was used. This research will open a new way of Modeling Equations instead of transfer functions in MATLAB (Matrix Laboratory) Simulink. Using the model, it was developed; with controller, so as to manipulate the output temperature by simply controlling the flow rate. It can be justified weather the design of a new heat exchanger would be feasible or not for the specific requirements. At last this research is very helpful in Industries for the purpose of designing, development and control of new Heat Exchangers. (author)

  4. Advanced Heat/Mass Exchanger Technology for Geothermal and Solar Renewable Energy Systems

    Energy Technology Data Exchange (ETDEWEB)

    Greiner, Miles [Univ. of Nevada, Reno, NV (United States); Childress, Amy [Univ. of Nevada, Reno, NV (United States); Hiibel, Sage [Univ. of Nevada, Reno, NV (United States); Kim, Kwang [Univ. of Nevada, Reno, NV (United States); Park, Chanwoo [Univ. of Nevada, Reno, NV (United States); Wirtz, Richard [Univ. of Nevada, Reno, NV (United States)

    2014-12-16

    Northern Nevada has abundant geothermal and solar energy resources, and these renewable energy sources provide an ample opportunity to produce economically viable power. Heat/mass exchangers are essential components to any energy conversion system. Improvements in the heat/mass exchange process will lead to smaller, less costly (more efficient) systems. There is an emerging heat transfer technology, based on micro/nano/molecular-scale surface science that can be applied to heat/mass exchanger design. The objective is to develop and characterize unique coating materials, surface configurations and membranes capable of accommodating a 10-fold increase in heat/mass exchanger performance via phase change processes (boiling, condensation, etc.) and single phase convective heat/mass transfer.

  5. Molecular recognition in a diverse set of protein-ligand interactions studied with molecular dynamics simulations and end-point free energy calculations.

    Science.gov (United States)

    Wang, Bo; Li, Liwei; Hurley, Thomas D; Meroueh, Samy O

    2013-10-28

    End-point free energy calculations using MM-GBSA and MM-PBSA provide a detailed understanding of molecular recognition in protein-ligand interactions. The binding free energy can be used to rank-order protein-ligand structures in virtual screening for compound or target identification. Here, we carry out free energy calculations for a diverse set of 11 proteins bound to 14 small molecules using extensive explicit-solvent MD simulations. The structure of these complexes was previously solved by crystallography and their binding studied with isothermal titration calorimetry (ITC) data enabling direct comparison to the MM-GBSA and MM-PBSA calculations. Four MM-GBSA and three MM-PBSA calculations reproduced the ITC free energy within 1 kcal·mol(-1) highlighting the challenges in reproducing the absolute free energy from end-point free energy calculations. MM-GBSA exhibited better rank-ordering with a Spearman ρ of 0.68 compared to 0.40 for MM-PBSA with dielectric constant (ε = 1). An increase in ε resulted in significantly better rank-ordering for MM-PBSA (ρ = 0.91 for ε = 10), but larger ε significantly reduced the contributions of electrostatics, suggesting that the improvement is due to the nonpolar and entropy components, rather than a better representation of the electrostatics. The SVRKB scoring function applied to MD snapshots resulted in excellent rank-ordering (ρ = 0.81). Calculations of the configurational entropy using normal-mode analysis led to free energies that correlated significantly better to the ITC free energy than the MD-based quasi-harmonic approach, but the computed entropies showed no correlation with the ITC entropy. When the adaptation energy is taken into consideration by running separate simulations for complex, apo, and ligand (MM-PBSAADAPT), there is less agreement with the ITC data for the individual free energies, but remarkably good rank-ordering is observed (ρ = 0.89). Interestingly, filtering MD snapshots by prescoring

  6. ASN.1 notation for exchange of data in computer-based railway control systems

    Directory of Open Access Journals (Sweden)

    Zbigniew ŁUKASIK

    2009-01-01

    Full Text Available Development of railway control systems aims at computerization. In most cases these systems are Distributed Real Time Systems. However, a huge problem in their putting into practice is the lack of interface standardization in the range of data structures and information exchange methods. It results in a variety of solutions, and thus in problems concerning cooperation of systems that come from different software vendors. Specification of protocols for data exchanging applications should therefore be created with the use of generally accepted standards. One of them is ASN.1 (Abstract Syntax Notation One language, which shall be presented in this article.

  7. Vacuum system design and tritium inventory for the TFTR charge exchange diagnostic

    International Nuclear Information System (INIS)

    Medley, S.S.

    1979-05-01

    The charge exchange diagnostic for the TFTR is comprised of two analyzer systems which contain a total of twenty independent mass/energy analyzers and one diagnostic neutral beam tentatively rated at 80 keV, 15 A. The associated vacuum systems were analyzed using the Vacuum System Transient Simulator (VSTS) computer program which models the transient transport of multi-gas species through complex networks of ducts, valves, traps, vacuum pumps, and other related vacuum system components. In addition to providing improved design performance at reduced cost, the analysis yields estimates for the exchange of tritium from the torus to the diagnostic components and of the diagnostic working gases to the torus

  8. Characterization of primary coolant purification system samples for assay of spent ion exchanger radionuclide inventor

    International Nuclear Information System (INIS)

    Sajin Prasad, S.; Pant, Amar; Sharma, Ranjit; Pal, Sanjit

    2018-01-01

    The primary coolant system water of a research reactor contains various fission and activation products and the water is circulated continuously through ion exchange resin cartridges, to reduce the radioactive ionic impurity present in it. The coolant purification system comprises of an ion exchange cooler, two micro filters, and a battery of six ion exchanger beds, associated valves, piping and instrumentation (Heavy water System Operating manual, 2014). The spent cartridge is finally disposed off as active solid waste which contains predominantly long lived fission and activation products. The heavy water coolant is also used to cool the structural assemblies after passing through primary heat exchanger and a metallic strainer, which accumulates the fission and activation products. When there is a reduction of coolant flow through these strainers, they are removed for cleaning and decontamination. This paper describes the characterization of ion exchange resin samples and liquid effluent generated during ultra sonic decontamination of strainer. The results obtained can be used as a methodology for the assay of the spent ion exchanger cartridges radionuclide inventory, during its disposal

  9. Thermal Sizing of Heat Exchanger Tubes for Air Natural Convective Cooling System of Emergency Cooling Tank

    Energy Technology Data Exchange (ETDEWEB)

    Kim, Myoung Jun; Lee, Hee Joon [Kookmin Univ., Seoul (Korea, Republic of); Moon, Joo Hyung; Bae, Youngmin; Kim, Youngin [Korea Atomic Energy Research Institute, Daejeon (Korea, Republic of)

    2014-05-15

    For the long operation of secondary passive cooling system, however, water level goes down by evaporation in succession at emergency cooling tank. At the end there would be no place to dissipate heat from condensation heat exchanger. Therefore, steam cooling heat exchanger is put on the top of emergency cooling tank to maintain appropriate water level by collecting evaporating steam. Steam cooling heat exchanger is installed inside an air chimney and evaporated steam is cooled down by air natural convection. In this study, thermal sizing of steam cooling heat exchanger under air natural convection was conducted by TSCON program for the design of experimental setup as shown in Fig. 2. Thermal sizing of steam cooling heat exchanger tube under air natural convection was conducted by TSCON program for the design of experimental setup. 25 - 1' tubes which has a length 1687 mm was determined as steam cooling heat exchanger at 2 kW heat load and 100 liter water pool in emergency cooling tank (experimental limit condition). The corresponding width of two tubes is 50 mm and has 5 by 5 tube array for heat exchanger.

  10. Thermal Sizing of Heat Exchanger Tubes for Air Natural Convective Cooling System of Emergency Cooling Tank

    International Nuclear Information System (INIS)

    Kim, Myoung Jun; Lee, Hee Joon; Moon, Joo Hyung; Bae, Youngmin; Kim, Youngin

    2014-01-01

    For the long operation of secondary passive cooling system, however, water level goes down by evaporation in succession at emergency cooling tank. At the end there would be no place to dissipate heat from condensation heat exchanger. Therefore, steam cooling heat exchanger is put on the top of emergency cooling tank to maintain appropriate water level by collecting evaporating steam. Steam cooling heat exchanger is installed inside an air chimney and evaporated steam is cooled down by air natural convection. In this study, thermal sizing of steam cooling heat exchanger under air natural convection was conducted by TSCON program for the design of experimental setup as shown in Fig. 2. Thermal sizing of steam cooling heat exchanger tube under air natural convection was conducted by TSCON program for the design of experimental setup. 25 - 1' tubes which has a length 1687 mm was determined as steam cooling heat exchanger at 2 kW heat load and 100 liter water pool in emergency cooling tank (experimental limit condition). The corresponding width of two tubes is 50 mm and has 5 by 5 tube array for heat exchanger

  11. Investigations on installation of the heat exchange system in geothermal wells; Chinetsu koseinai netsukokan system donyu ni kansuru chosa

    Energy Technology Data Exchange (ETDEWEB)

    NONE

    1996-03-01

    The heat exchange system in geothermal wells is a system that replaces the air source heat pump and uses underground beds or groundwater as a heat source to heat rooms by collecting underground heat in winter, and cool rooms in summer by operating a heat media circuit in reverse direction through the action of a reverse flow valve to discharge heat underground. This paper describes feasibility investigations on the system including its technical trend for introducing the system technology. Technological and economic discussions were given by classifying the intra-well heat exchange device in its installation direction (horizontal loop type and vertical installation type), underground heat exchange media (antifreeze solution/water cyclic system and direct expansion system), and underground heat transfer (heat conduction system and heat convection system). As a result of discussing each system, it was concluded that the following two systems are promising: A = vertical installation, antifreeze solution/water cyclic and heat conduction system, and B = vertical installation, antifreeze solution/water cyclic and heat convection system. Since the system B was found to have better efficiency and economy among both systems, it is necessary to verify an intra-well heat exchange system and operation methods that suit the system B effectively. 21 refs., 8 tabs.

  12. Predicting binding affinities of protein ligands from three-dimensional models: application to peptide binding to class I major histocompatibility proteins

    DEFF Research Database (Denmark)

    Rognan, D; Lauemoller, S L; Holm, A

    1999-01-01

    A simple and fast free energy scoring function (Fresno) has been developed to predict the binding free energy of peptides to class I major histocompatibility (MHC) proteins. It differs from existing scoring functions mainly by the explicit treatment of ligand desolvation and of unfavorable protein...... coordinates of the MHC-bound peptide have first been determined with an accuracy of about 1-1.5 A. Furthermore, it may be easily recalibrated for any protein-ligand complex.......) and of a series of 16 peptides to H-2K(k). Predictions were more accurate for HLA-A2-binding peptides as the training set had been built from experimentally determined structures. The average error in predicting the binding free energy of the test peptides was 3.1 kJ/mol. For the homology model-derived equation...

  13. Optimization of memory use of fragment extension-based protein-ligand docking with an original fast minimum cost flow algorithm.

    Science.gov (United States)

    Yanagisawa, Keisuke; Komine, Shunta; Kubota, Rikuto; Ohue, Masahito; Akiyama, Yutaka

    2018-03-16

    The need to accelerate large-scale protein-ligand docking in virtual screening against a huge compound database led researchers to propose a strategy that entails memorizing the evaluation result of the partial structure of a compound and reusing it to evaluate other compounds. However, the previous method required frequent disk accesses, resulting in insufficient acceleration. Thus, more efficient memory usage can be expected to lead to further acceleration, and optimal memory usage could be achieved by solving the minimum cost flow problem. In this research, we propose a fast algorithm for the minimum cost flow problem utilizing the characteristics of the graph generated for this problem as constraints. The proposed algorithm, which optimized memory usage, was approximately seven times faster compared to existing minimum cost flow algorithms. Copyright © 2018 The Authors. Published by Elsevier Ltd.. All rights reserved.

  14. The on-line European Community urgent radiological information exchange (ECURIE) information system

    International Nuclear Information System (INIS)

    De Cort, M.; Breitenbach, L.; De Vries, G.

    1998-01-01

    Immediately after the accident at the Chernobyl NPP, both the International Atomic Energy Agency (IAEA) and the Commission of the European Communities (CEC) set up a system to meet the requirements for early warning and exchange of information. The Environment Institute of the CEC JRC-Ispra provides technical assistance for the European community Urgent Radiological Information Exchange system (ECURIE). By this system, Member State contact points can exchange information in a coded format. In order to facilitate the use and to assure the data quality, a Coding-Decoding Software (CDS) was developed in collaboration with the I.A.E.A. A new version, called CoDecS, is under development. An ECURIE data bank is under construction, which will automatically recognize and store incoming ECURIE messages. Further on, query and reporting software will be developed. The background objectives and the conceptual basis for the structure of the on-line information system is described. (author)

  15. Development of a Waste Water Regenerative System - Using Sphagnum Moss Ion-exchange

    Science.gov (United States)

    McKeon, M.; Wheeler, R.; Leahy, Jj

    The use of inexpensive, light weight and regenerative systems in an enclosed environment is of great importance to sustained existence in such habitats as the International Space Station, Moon or even Mars. Many systems exist which utilise various synthetic ion exchangers to complete the process of waste water clean-up. These systems do have a very good exchange rate for cations but a very low exchange rate for anions. They also have a maximum capacity before they need regeneration. This research proposes a natural alternative to these synthetic ion-exchangers that utilises one of natures greatest ion-exchangers, that of Sphagnum Moss. Sphagna can be predominantly found in the nutrient poor environment of Raised Bogs, a type of isolated wetland with characteristic low pH and little interaction with the surrounding water table. All nutrients come from precipitation. The sphagna have developed as the bog's sponges, soaking up all available nutrients (both cation & anion) from the precipitation and eventually distributing them to the surrounding flora and fauna, through the water. The goal of this research is to use this ability in the processing of waste water from systems similar to isolated microgravity environments, to produce clean water for reuse in these environments. The nutrients taken up by the sphagna will also be utilised as a growth medium for cultivar growth, such as those selected for hydroponics' systems.

  16. Compact interior heat exchangers for CO{sub 2} mobile heat pumping systems

    Energy Technology Data Exchange (ETDEWEB)

    Hafner, Armin

    2003-07-01

    The natural refrigerant carbon dioxide (CO{sub 2}) offers new possibilities for design of flexible, efficient and environmentally safe mobile heat pumping systems. As high-efficient car engines with less waste heat are developed, extra heating of the passenger compartment is needed in the cold season. A reversible transcritical CO{sub 2} system with gliding temperature heat rejection can give high air delivery temperature which results in rapid heating of the passenger compartment and rapid defogging or defrosting of windows. When operated in cooling mode, the efficiency of transcritical CO{sub 2} systems is higher compared to common (HFC) air conditioning systems, at most dominant operating conditions. Several issues were identified for the design of compact interior heat exchangers for automotive reversible CO{sub 2} heat pumping systems. Among theses issues are: (1) Refrigerant flow distribution, (2) Heat exchanger fluid flow circuiting, (3) Air temperature uniformity downstream of the heat exchanger, (4) Minimization of temperature approach, (5) Windshield flash fogging due to retained water inside the heat exchanger, (6) Internal beat conduction in heating mode operation, and (7) Refrigerant side pressure drop In order to provide a basis for understanding these issues, the author developed a calculation model and set up a test facility and investigated different prototype heat exchangers experimentally.

  17. Experimental investigation on an integrated thermal management system with heat pipe heat exchanger for electric vehicle

    OpenAIRE

    Zou, Huiming; Wang, Wei; Zhang, Guiying; Qin, Fei; Tian, Changqing; Yan, Yuying

    2016-01-01

    An integrated thermal management system combining a heat pipe battery cooling/preheating system with the heat pump air conditioning system is presented to fulfill the comprehensive energy utilization for electric vehicles. A test bench with battery heat pipe heat exchanger and heat pump air conditioning for a regular five-chair electric car is set up to research the performance of this integrated system under different working conditions. The investigation results show that as the system is d...

  18. The evolutionary synchronization of the exchange rate system in ASEAN+6

    Science.gov (United States)

    Feng, Xiaobing; Hu, Haibo; Wang, Xiaofan

    2010-12-01

    Although there are extensive researches on the behavior of the world currency network, the complexity of the Asian regional currency system is not well understood regardless of its importance. Using daily exchange rates this paper examines exchange rate co-movements in the region before and after the China exchange rate reform. It was found that the correlation between Asian currencies and the US Dollar, the previous regional key currency has become weaker and intra-Asia interactions have increased. Cross sample entropy and cross entropy approaches are also applied to examine the synchrony behavior among the Asian currencies. The study also shows that the Asian exchange rate markets featured are neither stochastic nor efficient. These findings may shed some light on the in-depth understanding of collective behaviors in a regional currency network; they will also lay a theoretical foundation for further policy formulation in Asian currency integration.

  19. NMR magnetization exchange dynamics for three spin-1/2 systems

    International Nuclear Information System (INIS)

    Demco, D.E.; Filip, X.; Filip, C.

    1997-01-01

    The magnetization exchange dynamics in one-dimensional NMR exchange experiments performed with static samples is analyzed for the relevant case of three spin systems. The magnetization decays recorded in the experiments performed with different chemical shift filters for the short mixing times are derived analytically. In this regime the decay rates depend on the dipolar coupling between the spins belonging to different functional groups. The predictions of the theoretical model are compared with the magnetization exchange data obtained for cross-linked poly(styrene-co-butadiene) samples. The residual dipolar coupling between the functional CH- and CH2-groups of butadiene are measured from the magnetization exchange experiments in the short mixing time regime. (authors)

  20. Radiology Reporting System Data Exchange With the Electronic Health Record System: A Case Study in Iran.

    Science.gov (United States)

    Ahmadi, Maryam; Ghazisaeidi, Marjan; Bashiri, Azadeh

    2015-03-18

    In order to better designing of electronic health record system in Iran, integration of health information systems based on a common language must be done to interpret and exchange this information with this system is required. This study provides a conceptual model of radiology reporting system using unified modeling language. The proposed model can solve the problem of integration this information system with the electronic health record system. By using this model and design its service based, easily connect to electronic health record in Iran and facilitate transfer radiology report data. This is a cross-sectional study that was conducted in 2013. The study population was 22 experts that working at the Imaging Center in Imam Khomeini Hospital in Tehran and the sample was accorded with the community. Research tool was a questionnaire that prepared by the researcher to determine the information requirements. Content validity and test-retest method was used to measure validity and reliability of questioner respectively. Data analyzed with average index, using SPSS. Also Visual Paradigm software was used to design a conceptual model. Based on the requirements assessment of experts and related texts, administrative, demographic and clinical data and radiological examination results and if the anesthesia procedure performed, anesthesia data suggested as minimum data set for radiology report and based it class diagram designed. Also by identifying radiology reporting system process, use case was drawn. According to the application of radiology reports in electronic health record system for diagnosing and managing of clinical problem of the patient, with providing the conceptual Model for radiology reporting system; in order to systematically design it, the problem of data sharing between these systems and electronic health records system would eliminate.

  1. The Role of Dissonance in Knowledge Exchange: A Case Study of a Knowlegde Management System Implementation

    NARCIS (Netherlands)

    Pumareja, D.T.; Sikkel, Nicolaas

    This study examines the non-adoption of a knowledge management system for knowledge exchange among a distributed group of non-life insurance experts. The users participated with enthusiasm in the design process where they provided functional and data specifications for the system. However, a few

  2. The Effects of Behavioral Skills Training on Implementation of the Picture Exchange Communication System

    Science.gov (United States)

    Rosales, Rocio; Stone, Karen; Rehfeldt, Ruth Anne

    2009-01-01

    The effectiveness of a behavioral skills training (BST) package to teach the implementation of the first three phases of the picture exchange communication system (PECS) was evaluated with 3 adults who had no history teaching any functional communication system. A multiple baseline design across participants was used to evaluate the effectiveness…

  3. An Evaluation of Strategies for Training Staff to Implement the Picture Exchange Communication System

    Science.gov (United States)

    Barnes, Clarissa S.; Dunning, Johnna L.; Rehfeldt, Ruth Anne

    2011-01-01

    The picture exchange communication system (PECS) is a functional communication system frequently used with individuals diagnosed with autism spectrum disorders who experience severe language delays (Frost & Bondy, 2002). Few empirical investigations have evaluated strategies for training direct care staff how to effectively implement PECS with…

  4. The Effectiveness of the "Picture Exchange Communication System" with Nonspeaking Adults

    Science.gov (United States)

    Stoner, Julia B.; Beck, Ann R.; Bock, Stacey Jones; Hickey, Katherine; Kosuwan, Kullaya; Thompson, James R.

    2006-01-01

    "Picture Exchange Communication System" (PECS) training was implemented with 5 nonspeaking adults with mental retardation who were not currently using any type of functional communication system. A modified ABAB, single-subject design was used to assess the effectiveness of PECS in enhancing the functional communication skills of these…

  5. A new cascade method for studying isotope effect in chemical exchange system without valance change

    International Nuclear Information System (INIS)

    Wen Xiaoning; Luo Wenzong

    1987-01-01

    A new cascade method for studying isotope effect in chemical exchange system without valance change is developed and described. This method is simple to use and consumes less extractant as compared with the commonly used Woodward method. It is also convenient for unstable systems

  6. Annual simulations of heat pump systems with vertical ground heat exchangers

    Energy Technology Data Exchange (ETDEWEB)

    Bernier, M.A.; Randriamiarinjatovo, D. [Ecole Polytechnique, Montreal, PQ (Canada). Dept. de Genie Mecanique

    2001-06-01

    The recent increased popularity in ground-coupled heat pump (GCHP) systems is due to their energy saving potential. However, in order for a GCHP to operate efficiently, they must be sized correctly. This paper presents a method to perform annual simulations of GCHP systems to optimize the length of the ground heat exchanger and provide annual energy consumption data. A computer program has been developed to simulate the building load, heat pump and the ground heat exchanger, the three most distinct parts of the system. The coupled governing equations of these three models are solved simultaneously until a converged solution is obtained at each time step. The simulations are performed using the Engineering Equation Solver (EES). This program has proven to be useful in balancing ground heat exchanger length against heat pump energy consumption.15 refs., 9 figs.

  7. Development of laser cladding system to repair wall thinning of 1-inch heat exchanger tube

    International Nuclear Information System (INIS)

    Terada, Takaya

    2013-01-01

    We developed a laser cladding system to repair the inner wall wastage of heat exchanger tubes. Our system, which is designed to repair thinning tube walls within 100 mm from the edge of a heat exchanger tube, consists of a fiber laser, a composite-type optical fiberscope, a coupling device, a laser processing head, and a wire-feeding device. All of these components were reconfigured from the technologies of FBR maintenance. The laser processing head, which has a 15-mm outer diameter, was designed to be inserted into a 1-inch heat exchanger tube. We mounted a heatproof broadband mirror for laser cladding and fiberscope observation with visible light inside the laser processing head. The wire-feeding device continuously supplied 0.4-mm wire to the laser irradiation spot with variable feeding speeds from 0.5 to 20 mm/s. We are planning to apply our proposed system to the maintenance of aging industrial plants. (author)

  8. A COUNTER-CURRENT HEAT EXCHANGE SYSTEM IN THE TAIL ...

    African Journals Online (AJOL)

    tion of blood returning by the median system under cool conditions. .... Effect of changing ambient temperature (Ta) on core temperature (Tc). caudal .... Considering the relative thickness of the human fore-arm and vervet caudal arteries at the.

  9. A platform independent prototype for data and information exchange between decision support systems

    International Nuclear Information System (INIS)

    Carle, B.; Baig, S.

    2003-01-01

    Full text: A survey amongst participants in the Decision Support System network (DSSNET) community showed that the organization dealing with the Information exchange between participants and stakeholders in nuclear emergency is too disparate to be defined in one well defined procedure or analysis. Looking at the organization of the national emergency response organizations, and especially when modelling the information flow, diversity is the most striking finding: originators of the information are different, decision making organisation can be different, the approval and publishing of information to press and wider public is dealt with in different ways and the responsibilities for the information flow to other authorities differ as well. Moreover, the place of decision support systems (DSS) in the emergency response organization varies for the different countries. This variation can be found in the way one of the 'big three' (RODOS, ARGOS and RECASS) systems is implemented, and even more in the way other, often country-specific systems, are in use and function more integrated with the particular emergency response organization of the country. Hence we can conclude that there is a need to structure the information exchange system, but this has to be flexible enough to work with the above described variety of existing organizations and procedures. Though it may not be feasible to agree on all specifications of information to be exchanged, we can define at least a minimal set. A prototype for data and information exchange is being developed under the EC project MODEM (Monitoring data and Information exchange among decision support systems). It establishes links between the decision support systems RODOS, ARGOS and RECASS. For setting up this data exchange, the use of xml-based data specifications allows a flexible integration with existing applications. The power to include metadata in a structured way allows the use of automated transformation tools and limits the

  10. Are there differences in health information exchange by health system type?

    Science.gov (United States)

    Opoku-Agyeman, William; Menachemi, Nir

    2016-01-01

    Despite the potential of health information exchange (HIE) to improve safety and reduce cost, hospitals have been slow to adopt HIE with only 30% of U.S. hospitals doing so in 2012. The aim of this study was to explore the relationship between different health system types and how they engage in HIE. Data on health system types and engagement in HIE activity were combined with secondary hospital characteristics. Ordinal logistic regression analyses were used to examine the relationship between a scale measuring the level of HIE engagement and health system type controlling for hospital and market characteristics. Data from 1552 hospitals were available for analyses. Overall, hospital in a health system of any kind exchanged more patient data elements (e.g., patient demographics, clinical summaries, laboratory results, medication history, and radiology report) compared with stand-alone hospitals (3.82 vs. 1.80, p centralized health systems, 75 (4.8%) were in centralized physician/insurance health system, 284 (18.3%) were in moderately centralized health system, 391 (25.2%) were in decentralized health system, and 91 (5.9%) were in independent health system. In regression analyses, hospitals belonging to a health system were more likely to exchange patient health data with other hospitals in the same system (OR = 3.94, p < .001) but not with hospitals outside their system (OR = 1.89, p = .445). Across health system types, there was no significant difference in the exchange of patient health data. Hospital engagement in HIE is associated with health system membership. These findings will assist hospital leaders and managers to better understand how the structure and nature of their system may influence what their individual hospital can and cannot do in their decision to engage in HIE and other decisions that support the overall system objectives.

  11. Ion exchange equilibrium for some uni-univalent and uni-divalent reaction systems using strongly basic anion exchange resin Duolite A-102 D

    Directory of Open Access Journals (Sweden)

    R.S. Lokhande

    2008-04-01

    Full Text Available The study on thermodynamics of ion exchange equilibrium for uni-univalent Cl-/I-, Cl-/Br-, and uni-divalent Cl-/SO42-, Cl-/C2O42- reaction systems was carried out using ion exchange resin Duolite A-102 D. The equilibrium constant K was calculated by taking into account the activity coefficient of ions both in solution as well as in the resin phase. The K values calculated for uni-univalent and uni-divalent anion exchange reaction systems was observed to increase with rise in temperature, indicating the endothermic exchange reactions having enthalpy values of 13.7, 38.0, 23.9, 22.9 kJ/mol, respectively.

  12. Recent trends in the development of heat exchangers for geothermal systems

    Science.gov (United States)

    Franco, A.; Vaccaro, M.

    2017-11-01

    The potential use of geothermal resources has been a remarkable driver for market players and companies operating in the field of geothermal energy conversion. For this reason, medium to low temperature geothermal resources have been the object of recent rise in consideration, with strong reference to the perspectives of development of Organic Rankine Cycle (ORC) technology. The main components of geothermal plants based on ORC cycle are surely the heat exchangers. A lot of different heat exchangers are required for the operation of ORC plants. Among those it is surely of major importance the Recovery Heat Exchanger (RHE, typically an evaporator), in which the operating fluid is evaporated. Also the Recuperator, in regenerative Organic Rankine Cycle, is of major interest in technology. Another important application of the heat exchangers is connected to the condensation, according to the possibility of liquid or air cooling media availability. The paper analyzes the importance of heat exchangers sizing and the connection with the operation of ORC power plants putting in evidence the real element of innovation: the consideration of the heat exchangers as central element for the optimum design of ORC systems.

  13. Nanofiltration: ion exchange system for effective surfactant removal from water solutions

    Directory of Open Access Journals (Sweden)

    I. Kowalska

    2014-12-01

    Full Text Available A system combining nanofiltration and ion exchange for highly effective separation of anionic surfactant from water solutions was proposed. The subjects of the study were nanofiltration polyethersulfone membranes and ion-exchange resins differing in type and structure. The quality of the treated solution was affected by numerous parameters, such as quality of the feed solution, membrane cut-off, resin type, dose and the solution contact time with the resin. A properly designed purification system made it possible to reduce the concentration of anionic surfactant below 1 mg L-1 from feed solutions containing surfactant in concentrations above the CMC value.

  14. Energy exchange in systems of particles with nonreciprocal interaction

    Energy Technology Data Exchange (ETDEWEB)

    Vaulina, O. S.; Lisina, I. I., E-mail: Irina.Lisina@mail.ru; Lisin, E. A. [Russian Academy of Sciences, Joint Institute for High Temperatures (Russian Federation)

    2015-10-15

    A model is proposed to describe the sources of additional kinetic energy and its redistribution in systems of particles with a nonreciprocal interaction. The proposed model is shown to explain the qualitative specific features of the dust particle dynamics in the sheath region of an RF discharge. Prominence is given to the systems of particles with a quasi-dipole–dipole interaction, which is similar to the interaction induced by the ion focusing effects that occur in experiments on a laboratory dusty plasma, and with the shadow interaction caused by thermophoretic forces and Le Sage’s forces.

  15. Weak ferromagnetism and exchange biasing in cobalt oxide nanoparticle systems

    NARCIS (Netherlands)

    Tomou, A; Gournis, D; Panagiotopoulos, [No Value; Huang, Y; Hadjipanayis, GC; Kooi, BJ; Panagiotopoulos, I.

    2006-01-01

    Cobalt oxide nanoparticle systems have been prepared by wet chemical processing involving the encapsulation of the nanoparticles by an organic ligand shell (oleic acid and oleylamine). CoO nanoparticles were easily prepared by this method, while the synthesis of the CoPt/CoO nanocomposites was

  16. Free Floating Exchange Rate System Dan Penerapannya Pada Kebijaksanaan Ekonomi Di Negara Yang Berperekonomian Kecil Dan Terbuka

    OpenAIRE

    Atmadja, Adwin Surya

    2001-01-01

    Since the Bretton Wood sistem collapsed in early 1970s, the free floating exchange rate system has been being applied in many countries around the world. The exchange rate system choice is based on some economic advantages that will be obtained from it, considering some economic disadvantages that might be occurred. The valuation toward the advantages and disadvantages of the exchange rate system implementation exactly depends on the national economy it self, because such economy will give so...

  17. FREE FLOATING EXCHANGE RATE SYSTEM DAN PENERAPANNYA PADA KEBIJAKSANAAN EKONOMI DI NEGARA YANG BERPEREKONOMIAN KECIL DAN TERBUKA

    OpenAIRE

    Adwin Surya Atmadja

    2001-01-01

    Since the Bretton Wood sistem collapsed in early 1970s, the free floating exchange rate system has been being applied in many countries around the world. The exchange rate system choice is based on some economic advantages that will be obtained from it, considering some economic disadvantages that might be occurred. The valuation toward the advantages and disadvantages of the exchange rate system implementation exactly depends on the national economy it self, because such economy will give so...

  18. Segmented heat exchanger

    Science.gov (United States)

    Baldwin, Darryl Dean; Willi, Martin Leo; Fiveland, Scott Byron; Timmons, Kristine Ann

    2010-12-14

    A segmented heat exchanger system for transferring heat energy from an exhaust fluid to a working fluid. The heat exchanger system may include a first heat exchanger for receiving incoming working fluid and the exhaust fluid. The working fluid and exhaust fluid may travel through at least a portion of the first heat exchanger in a parallel flow configuration. In addition, the heat exchanger system may include a second heat exchanger for receiving working fluid from the first heat exchanger and exhaust fluid from a third heat exchanger. The working fluid and exhaust fluid may travel through at least a portion of the second heat exchanger in a counter flow configuration. Furthermore, the heat exchanger system may include a third heat exchanger for receiving working fluid from the second heat exchanger and exhaust fluid from the first heat exchanger. The working fluid and exhaust fluid may travel through at least a portion of the third heat exchanger in a parallel flow configuration.

  19. Invariant exchange perturbation theory for multicenter systems: Time-dependent perturbations

    International Nuclear Information System (INIS)

    Orlenko, E. V.; Evstafev, A. V.; Orlenko, F. E.

    2015-01-01

    A formalism of exchange perturbation theory (EPT) is developed for the case of interactions that explicitly depend on time. Corrections to the wave function obtained in any order of perturbation theory and represented in an invariant form include exchange contributions due to intercenter electron permutations in complex multicenter systems. For collisions of atomic systems with an arbitrary type of interaction, general expressions are obtained for the transfer (T) and scattering (S) matrices in which intercenter electron permutations between overlapping nonorthogonal states belonging to different centers (atoms) are consistently taken into account. The problem of collision of alpha particles with lithium atoms accompanied by the redistribution of electrons between centers is considered. The differential and total charge-exchange cross sections of lithium are calculated

  20. Resonating-group study and importance of exchange effects in the α + 6Li system

    International Nuclear Information System (INIS)

    Suenkel, W.; Tang, Y.C.

    1979-01-01

    The resonating-group method in the one-channel approximation is used to investigate the α + 6 Li system. The result shows that, especially at relatively high energies, reasonable agreement with experiment can be obtained. In particular, the cross section rise in the backward angular region is well reproduced. The effects of internuclear antisymmetrization, represented by various nucleon-exchange terms in the kernel function, are also carefully examined. Some of the interesting findings are that the blocking effect is quite significant in this system and the two-exchange terms (sometimes even the three-exchange terms) seem to have only minor influence on the scattering cross section. 7 figures, 1 table

  1. Harmonised information exchange between decentralised food composition database systems

    DEFF Research Database (Denmark)

    Pakkala, Heikki; Christensen, Tue; Martínez de Victoria, Ignacio

    2010-01-01

    documentation and by the use of standardised thesauri. Subjects/Methods: The data bank is implemented through a network of local FCD storages (usually national) under the control and responsibility of the local (national) EuroFIR partner. Results: The implementation of the system based on the Euro......FIR specifications is under development. The data interchange happens through the EuroFIR Web Services interface, allowing the partners to implement their system using methods and software suitable for the local computer environment. The implementation uses common international standards, such as Simple Object...... Access Protocol, Web Service Description Language and Extensible Markup Language (XML). A specifically constructed EuroFIR search facility (eSearch) was designed for end users. The EuroFIR eSearch facility compiles queries using a specifically designed Food Data Query Language and sends a request...

  2. A computational model of insect discontinuous gas exchange: A two-sensor, control systems approach.

    Science.gov (United States)

    Grieshaber, Beverley J; Terblanche, John S

    2015-06-07

    The insect gas exchange system is characterised by branching air-filled tubes (tracheae/tracheoles) and valve-like structures in their outer integument (spiracles) which allow for a periodic gas exchange pattern known as the discontinuous gas exchange cycle (DGC). The DGC facilitates the temporal decoupling of whole animal gas exchange from cellular respiration rates and may confer several physiological benefits, which are nevertheless highly controversial (primarily reduction of cellular oxidative damage and/or respiratory water saving). The intrinsic and extrinsic factors influencing DGCs are the focus of extensive ongoing research and little consensus has been reached on the evolutionary genesis or mechanistic costs and benefits of the pattern. Despite several hypotheses and much experimental and evolutionary biology research, a mechanistic physical model, which captures various key elements of the DGC pattern, is currently lacking. Here, we present a biologically realistic computational, two-sensor DGC model (pH/carbon dioxide and oxygen setpoints) for an Orthopteran gas exchange system, and show computationally for the first time that a control system of two interacting feedback loops is capable of generating a full DGC pattern with outputs which are physiologically realistic, quantitatively matching experimental results found in this taxonomic model elsewhere. A finite-element mathematical approach is employed and various trigger sets are considered. Parameter sensitivity analyses suggest that various aspects of insect DGC are adequately captured in this model. In particular, with physiologically relevant input parameters, the full DGC pattern is induced; and the phase durations, endotracheal carbon dioxide partial pressure ranges, and pH fluctuations which arise are physically realistic. The model results support the emergent property hypothesis for the existence of DGC, and indicate that asymmetric loading and off-loading (hysteresis) in one of the sensor

  3. Efficient data exchange: Integrating a vector GIS with an object-oriented, 3-D visualization system

    International Nuclear Information System (INIS)

    Kuiper, J.; Ayers, A.; Johnson, R.; Tolbert-Smith, M.

    1996-01-01

    A common problem encountered in Geographic Information System (GIS) modeling is the exchange of data between different software packages to best utilize the unique features of each package. This paper describes a project to integrate two systems through efficient data exchange. The first is a widely used GIS based on a relational data model. This system has a broad set of data input, processing, and output capabilities, but lacks three-dimensional (3-D) visualization and certain modeling functions. The second system is a specialized object-oriented package designed for 3-D visualization and modeling. Although this second system is useful for subsurface modeling and hazardous waste site characterization, it does not provide many of the, capabilities of a complete GIS. The system-integration project resulted in an easy-to-use program to transfer information between the systems, making many of the more complex conversion issues transparent to the user. The strengths of both systems are accessible, allowing the scientist more time to focus on analysis. This paper details the capabilities of the two systems, explains the technical issues associated with data exchange and how they were solved, and outlines an example analysis project that used the integrated systems

  4. Preliminary Study of Printed Circuit Heat Exchanger (PCHE) for various power conversion systems for SMART

    Energy Technology Data Exchange (ETDEWEB)

    Kwon, Jinsu; Baik, Seungjoon; Lee, Jeong Ik [KAIST, Daejeon (Korea, Republic of)

    2016-10-15

    The steam-Rankine cycle was the most widely used power conversion system for a nuclear power plant. The size of the heat exchanger is important for the modulation. Such a challenge was conducted by Kang et al. They change the steam generator type for the SMART from helical type heat exchanger to Printed Circuit Heat Exchanger (PCHE). Recently, there has been a growing interest in the supercritical carbon dioxide (S-CO{sub 2}) Brayton cycle as the most promising power conversion system. The reason is high efficiency with simple layout and compact power plant due to small turbomachinery and compact heat exchanger technology. That is why the SCO{sub 2} Brayton cycle can enhance the existing advantages of Small Modular Reactor (SMR) like SMART, such as reduction in size, capital cost, and construction period. Thermal hydraulic and geometric parameters of a PCHE for the S-CO{sub 2} power cycle coupled to SMART. The results show that the water - CO{sub 2} printed circuit heat exchanger size is smaller than printed circuit steam generator for the superheated steam Rankine cycle. This results show the potential benefit of using the S-CO-2 Brayton power cycle to a water-cooled small modular reactor.

  5. Characterization of a mini-channel heat exchanger for a heat pump system

    International Nuclear Information System (INIS)

    Arteconi, A; Giuliani, G; Tartuferi, M; Polonara, F

    2014-01-01

    In this paper a mini-channel aluminum heat exchanger used in a reversible heat pump is presented. Mini-channel finned heat exchangers are getting more and more interest for refrigeration systems, especially when compactness and low refrigerant charge are desired. Purpose of this paper was to characterize the mini-channel heat exchanger used as evaporator in terms of heat transfer performance and to study the refrigerant distribution in the manifold. The heat exchanger characterization was performed experimentally by means of a test rig built up for this purpose. It is composed of an air-to-air heat pump, air channels for the external and internal air circulation arranged in a closed loop, measurement sensors and an acquisition system. The overall heat transfer capacity was assessed. Moreover, in order to characterize the flow field of the refrigerant in the manifold of the heat exchanger, a numerical investigation of the fluid flow by means of CFD was performed. It was meant to evaluate the goodness of the present design and to identify possible solutions for the future improvement of the manifold design.

  6. Potential energy surfaces for nucleon exchanging in dinuclear systems

    International Nuclear Information System (INIS)

    Li Jianfeng; Xu Hushan; Li Wenfei; Zuo Wei; Li Junqing; Wang Nan; Zhao Enguang

    2003-01-01

    The experimental measurements have provided the evidence that the suppression of fusion cross-section caused by quasi-fission is very important for the synthesis of super-heavy nuclei by heavy ion collisions. The potential energy surface due to the nucleon transfer in the collision process is the driven potential, which governs the nucleon transfer, so that governs the competition between the fusion and quasi-fission. The dinuclear system potential energy surface also gives the information about the optimum projectile-target combination, as well as the optimum excitation energy for the synthesis of super-heavy nuclei by heavy ion collisions

  7. Uncertainty quantification of surface-water/groundwater exchange estimates in large wetland systems using Python

    Science.gov (United States)

    Hughes, J. D.; Metz, P. A.

    2014-12-01

    Most watershed studies include observation-based water budget analyses to develop first-order estimates of significant flow terms. Surface-water/groundwater (SWGW) exchange is typically assumed to be equal to the residual of the sum of inflows and outflows in a watershed. These estimates of SWGW exchange, however, are highly uncertain as a result of the propagation of uncertainty inherent in the calculation or processing of the other terms of the water budget, such as stage-area-volume relations, and uncertainties associated with land-cover based evapotranspiration (ET) rate estimates. Furthermore, the uncertainty of estimated SWGW exchanges can be magnified in large wetland systems that transition from dry to wet during wet periods. Although it is well understood that observation-based estimates of SWGW exchange are uncertain it is uncommon for the uncertainty of these estimates to be directly quantified. High-level programming languages like Python can greatly reduce the effort required to (1) quantify the uncertainty of estimated SWGW exchange in large wetland systems and (2) evaluate how different approaches for partitioning land-cover data in a watershed may affect the water-budget uncertainty. We have used Python with the Numpy, Scipy.stats, and pyDOE packages to implement an unconstrained Monte Carlo approach with Latin Hypercube sampling to quantify the uncertainty of monthly estimates of SWGW exchange in the Floral City watershed of the Tsala Apopka wetland system in west-central Florida, USA. Possible sources of uncertainty in the water budget analysis include rainfall, ET, canal discharge, and land/bathymetric surface elevations. Each of these input variables was assigned a probability distribution based on observation error or spanning the range of probable values. The Monte Carlo integration process exposes the uncertainties in land-cover based ET rate estimates as the dominant contributor to the uncertainty in SWGW exchange estimates. We will discuss

  8. Is It Possible To Use Intelligent Systems To Design A Profitable Foreign Exchange Trading Agent?

    OpenAIRE

    Julian, Pomfret-Pudelsky

    2009-01-01

    In this paper, a trading agent is developed using a basket of intelligent systems with the goal of trading the GBPUSD currency pair profitably in the Foreign Exchange market. The basket of intelligent system consists of two regression models: a radial basis neural network and a TSK-fuzzy inference system; and three classification models: k-nearest neighbour, support vector machine and a decision tree. The trading strategy combines the predictions of each model using a Kalman-type filter to...

  9. Multi-column step-gradient chromatography system for automated ion exchange separations

    International Nuclear Information System (INIS)

    Rucker, T.L.

    1985-01-01

    A multi-column step-gradient chromatography system has been designed to perform automated sequential separations of radionuclides by ion exchange chromatography. The system consists of a digital programmer with automatic stream selection valve, two peristaltic pumps, ten columns, and a fraction collector. The automation allows complicated separations of radionuclides to be made with minimal analyst attention and allows for increased productivity and reduced cost of analyses. Results are reported for test separations on mixtures of radionuclides by the system

  10. Modeling and simulation of control system response to temperature disturbances in a coupled heat exchangers-AHTR system

    International Nuclear Information System (INIS)

    Skavdahl, I.; Utgikar, V.P.; Christensen, R.; Sabharwall, P.; Chen, M.; Sun, X.

    2016-01-01

    Highlights: • Control architecture defined for nuclear reactor-coupled heat exchangers system. • MATLAB code developed for simulation of system response for various temperature disturbances in the system. • Control system effective in maintaining controlled variables at desired set points. • New equilibrium steady state established using controllers. • Adaptive control system capable of switching manipulated variables based on system constraints. - Abstract: An effective control strategy is essential for maintaining optimum operational efficiency of the Advanced High Temperature Reactor (AHTR)-intermediate heat exchanger (IHX)-secondary heat exchanger (SHX) system for power conversion or process heat applications. A control system design is presented in this paper for the control of the coupled intermediate and secondary heat exchangers. The cold side outlet temperature of the SHX (T_c_o) and the hot side outlet temperature of the IHX (T_h_o_2) were identified as the controlled variables that were maintained at their set points by manipulating the flow rates of heat exchange media. Transfer functions describing the relationships between the controlled variables and the manipulated and load variables were developed and the system response to various temperature disturbances was simulated using a custom-developed MATLAB program. It was found that a step disturbance of ±10 °C in the process loop changed the thermal duty by ±650 kW, equal to 6.5% of the initial duty. Similar disturbances in the primary loop had a higher impact on the system. The control system design included a provision for the switching of manipulated variables to limit the adjustment in the magnitudes of the primary manipulated variables. Simulation results indicate that the controlled variables are maintained successfully at their desired points by the control system.

  11. Modeling and simulation of control system response to temperature disturbances in a coupled heat exchangers-AHTR system

    Energy Technology Data Exchange (ETDEWEB)

    Skavdahl, I. [Department of Chemical and Materials Engineering, University of Idaho, Moscow, ID 83844 (United States); Utgikar, V.P., E-mail: vutgikar@uidaho.edu [Department of Chemical and Materials Engineering, University of Idaho, Moscow, ID 83844 (United States); Christensen, R. [Nuclear Engineering Program, University of Idaho, Idaho Falls, ID 83402 (United States); Sabharwall, P. [Idaho National Laboratory, Idaho Falls, ID 83415 (United States); Chen, M.; Sun, X. [Nuclear Engineering Program, Department of Mechanical and Aerospace Engineering, The Ohio State University, Columbus, OH 43210 (United States)

    2016-04-15

    Highlights: • Control architecture defined for nuclear reactor-coupled heat exchangers system. • MATLAB code developed for simulation of system response for various temperature disturbances in the system. • Control system effective in maintaining controlled variables at desired set points. • New equilibrium steady state established using controllers. • Adaptive control system capable of switching manipulated variables based on system constraints. - Abstract: An effective control strategy is essential for maintaining optimum operational efficiency of the Advanced High Temperature Reactor (AHTR)-intermediate heat exchanger (IHX)-secondary heat exchanger (SHX) system for power conversion or process heat applications. A control system design is presented in this paper for the control of the coupled intermediate and secondary heat exchangers. The cold side outlet temperature of the SHX (T{sub co}) and the hot side outlet temperature of the IHX (T{sub ho2}) were identified as the controlled variables that were maintained at their set points by manipulating the flow rates of heat exchange media. Transfer functions describing the relationships between the controlled variables and the manipulated and load variables were developed and the system response to various temperature disturbances was simulated using a custom-developed MATLAB program. It was found that a step disturbance of ±10 °C in the process loop changed the thermal duty by ±650 kW, equal to 6.5% of the initial duty. Similar disturbances in the primary loop had a higher impact on the system. The control system design included a provision for the switching of manipulated variables to limit the adjustment in the magnitudes of the primary manipulated variables. Simulation results indicate that the controlled variables are maintained successfully at their desired points by the control system.

  12. 18 CFR 301.4 - Exchange Period Average System Cost determination.

    Science.gov (United States)

    2010-04-01

    ... REGULATORY COMMISSION, DEPARTMENT OF ENERGY REGULATIONS FOR FEDERAL POWER MARKETING ADMINISTRATIONS AVERAGE... Period and extend through four (4) years after the Exchange Period. The load forecast for Contract System... Utility's ASC until the change in service territory takes place. (g) ASC determination for Consumer-owned...

  13. Heat exchanger modeling and identification for control of waste heat recovery systems in diesel engines

    NARCIS (Netherlands)

    Feru, E.; Willems, F.P.T.; Rojer, C.; Jager, B. de; Steinbuch, M.

    2013-01-01

    To meet future CO2 emission targets, Waste Heat Recovery systems have recently attracted much attention for automotive applications, especially for long haul trucks. This paper focuses on the development of a dynamic counter-flow heat exchanger model for control purposes. The model captures the

  14. A Preliminary Analysis of Teaching Improvisation with the Picture Exchange Communication System to Children with Autism

    Science.gov (United States)

    Marckel, Julie M.; Neef, Nancy A.; Ferreri, Summer J.

    2006-01-01

    Two young boys with autism who used the picture exchange communication system were taught to solve problems (improvise) by using descriptors (functions, colors, and shapes) to request desired items for which specific pictures were unavailable. The results of a multiple baseline across descriptors showed that training increased the number of…

  15. A Further Evaluation of Behavioral Skills Training for Implementation of the Picture Exchange Communication System

    Science.gov (United States)

    Homlitas, Christa; Rosales, Rocío; Candel, Lindsay

    2014-01-01

    We evaluated the effectiveness of a behavioral skills training package to teach implementation of Phases 1, 2, and 3A of the picture exchange communication system (PECS) to teachers employed at a therapeutic center for children with autism. Probes in the natural environment and follow-up were conducted with children who were assigned to work with…

  16. Social-Communicative Effects of the Picture Exchange Communication System (PECS) in Autism Spectrum Disorders

    Science.gov (United States)

    Lerna, Anna; Esposito, Dalila; Conson, Massimiliano; Russo, Luigi; Massagli, Angelo

    2012-01-01

    Background: The Picture Exchange Communication System (PECS) is a common treatment choice for non-verbal children with autism. However, little empirical evidence is available on the usefulness of PECS in treating social-communication impairments in autism. Aims: To test the effects of PECS on social-communicative skills in children with autism,…

  17. Experimental Evaluation of the Training Structure of the Picture Exchange Communication System (PECS)

    Science.gov (United States)

    Cummings, Anne R.; Carr, James E.; LeBlanc, Linda A.

    2012-01-01

    The Picture Exchange Communication System (PECS) is a picture-based alternative communication method that is widely accepted and utilized with individuals with disabilities. Although prior studies have examined the clinical efficacy of PECS, none have experimentally evaluated its manualized training structure. We experimentally evaluated the…

  18. Using the Picture Exchange Communication System with Students with Visual Impairment

    Science.gov (United States)

    Ivy, Sarah E.; Hatton, Deborah D.; Hooper, Jonathan D.

    2014-01-01

    Students with visual impairment (VI) were taught to request using the Picture Exchange Communication System (PECS) and tangible symbols. Participants were four males with additional disabilities, 5 to 11 years old, who had little to no functional vision. A functional relation between PECS Phase 1 and requesting was established using a multiple…

  19. Comparing the Picture Exchange Communication System and Sign Language Training for Children with Autism

    Science.gov (United States)

    Tincani, Matt

    2004-01-01

    This study compared the effects of Picture Exchange Communication System (PECS) and sign language training on the acquisition of mands (requests for preferred items) of students with autism. The study also examined the differential effects of each modality on students' acquisition of vocal behavior. Participants were two elementary school students…

  20. A Review of the Efficacy of the Picture Exchange Communication System Intervention

    Science.gov (United States)

    Preston, Deborah; Carter, Mark

    2009-01-01

    The Picture Exchange Communication System (PECS) is a communication program that has become widely used, especially with children with autism. This paper reports the results of a review of the empirical literature on PECS. A descriptive review is provided of the 27 studies identified, which included randomized controlled trials (RCTs), other group…

  1. The Picture Exchange Communication System: Communicative Outcomes for Young Children with Disabilities.

    Science.gov (United States)

    Schwartz, Ilene S.; Garfinkle, Ann N.; Bauer, Janet

    1998-01-01

    Presents two studies documenting the use of the Picture Exchange Communication System (PECS) for 31 preschool children with severe disabilities. Initial findings indicated the children could learn to use PECS quickly and efficiently. The second study, which included 18 participants, found that PECS use generalized to untrained settings. (Author/CR)

  2. Quantitative Synthesis and Component Analysis of Single-Participant Studies on the Picture Exchange Communication System

    Science.gov (United States)

    Tincani, Matt; Devis, Kathryn

    2011-01-01

    The "Picture Exchange Communication System" (PECS) has emerged as the augmentative communication intervention of choice for individuals with autism spectrum disorder (ASD), with a supporting body of single-participant studies. This report describes a meta-analysis of 16 single-participant studies on PECS with percentage of nonoverlapping data…

  3. The Picture Exchange Communication System (PECS): What Do the Data Say?

    Science.gov (United States)

    Sulzer-Azaroff, Beth; Hoffman, Anne O.; Horton, Catherine B.; Bondy, Andrew; Frost, Lori

    2009-01-01

    Originally designed to enable young children with autism lacking functional communication to initiate requests and to describe what they observed, the Picture Exchange Communication System (PECS) has been the subject of an ever-expanding body of research and development. Thirty-four peer-reviewed published reports on PECS are analyzed in this…

  4. Understanding the Picture Exchange Communication System and Its Application in Physical Education

    Science.gov (United States)

    Green, Amanda; Sandt, Dawn

    2013-01-01

    This article presents the Picture Exchange Communication System (PECS) and its applications in physical education. The PECS is an appropriate communication intervention for students with autism who lack functional communication skills. It is often confused with other visual support strategies, so the authors delineate the six phases of PECS and…

  5. Interoperability and models for exchange of data between information systems in public administration

    Science.gov (United States)

    Glavev, Victor

    2016-12-01

    The types of software applications used by public administrations can be divided in three main groups: document management systems, record management systems and business process systems. Each one of them generates outputs that can be used as input data to the others. This is the main reason that requires exchange of data between these three groups and well defined models that should be followed. There are also many other reasons that will be discussed in the paper. Interoperability is a key aspect when those models are implemented, especially when there are different manufactures of systems in the area of software applications used by public authorities. The report includes examples of implementation of models for exchange of data between software systems deployed in one of the biggest administration in Bulgaria.

  6. Investigation of heat exchangers for energy conversion systems of megawatt-class space power plants

    Science.gov (United States)

    Ilmov, D. N.; Mamontov, Yu. N.; Skorohodov, A. S.; Smolyarov, V. A.; Filatov, N. I.

    2016-01-01

    The specifics of operation (high temperatures in excess of 1000 K and large pressure drops of several megapascals between "hot" and "cold" coolant paths) of heat exchangers in the closed circuit of a gasturbine power converter operating in accordance with the Brayton cycle with internal heat recovery are analyzed in the context of construction of space propulsion systems. The design of a heat-exchange matrix made from doubly convex stamped plates with a specific surface relief is proposed. This design offers the opportunity to construct heat exchangers with the required parameters (strength, rigidity, weight, and dimensions) for the given operating conditions. The diagram of the working area of a test bench is presented, and the experimental techniques are outlined. The results of experimental studies of heat exchange and flow regimes in the models of heat exchangers with matrices containing 50 and 300 plates for two pairs of coolants (gas-gas and gas-liquid) are detailed. A criterion equation for the Nusselt number in the range of Reynolds numbers from 200 to 20 000 is proposed. The coefficients of hydraulic resistance for each coolant path are determined as functions of the Reynolds number. It is noted that the pressure in the water path in the "gas-liquid" series of experiments remained almost constant. This suggests that no well-developed processes of vaporization occurred within this heat-exchange matrix design even when the temperature drop between gas and water was as large as tens or hundreds of degrees. The obtained results allow one to design flight heat exchangers for various space power plants.

  7. Interface adjustment and exchange coupling in the IrMn/NiFe system

    Energy Technology Data Exchange (ETDEWEB)

    Spizzo, F.; Tamisari, M.; Chinni, F.; Bonfiglioli, E.; Del Bianco, L., E-mail: lucia.delbianco@unife.it

    2017-01-01

    The exchange bias effect was investigated, in the 5–300 K temperature range, in samples of IrMn [100 Å]/NiFe [50 Å] (set A) and in samples with inverted layer-stacking sequence (set B), produced at room temperature by DC magnetron sputtering in a static magnetic field of 400 Oe. The samples of each set differ for the nominal thickness (t{sub Cu}) of a Cu spacer, grown at the interface between the antiferromagnetic and ferromagnetic layers, which was varied between 0 and 2 Å. It has been found out that the Cu insertion reduces the values of the exchange field and of the coercivity and can also affect their thermal evolution, depending on the stack configuration. Indeed, the latter also determines a peculiar variation of the exchange bias properties with time, shown and discussed with reference to the samples without Cu of the two sets. The results have been explained considering that, in this system, the exchange coupling mechanism is ruled by the glassy magnetic behavior of the IrMn spins located at the interface with the NiFe layer. Varying the stack configuration and t{sub Cu} results in a modulation of the structural and magnetic features of the interface, which ultimately affects the spins dynamics of the glassy IrMn interfacial component. - Highlights: • Exchange bias effect in IrMn/NiFe samples with interfacial Cu spacer. • A variation of exchange bias with time is observed in as-deposited samples. • Magnetic modification of the interface by varying the stack sequence and Cu thickness. • Interface adjustment affects the dynamics of interfacial IrMn spins. • The exchange bias properties can be tuned by interface adjustment.

  8. Mixing rates of particle systems with energy exchange

    International Nuclear Information System (INIS)

    Grigo, A; Khanin, K; Szász, D

    2012-01-01

    A fundamental problem of non-equilibrium statistical mechanics is the derivation of macroscopic transport equations in the hydrodynamic limit. The rigorous study of such limits requires detailed information about rates of convergence to equilibrium for finite sized systems. In this paper, we consider the finite lattice {1, 2, …, N}, with an energy x i ∈ (0, ∞) associated with each site. The energies evolve according to a Markov jump process with nearest neighbour interaction such that the total energy is preserved. We prove that for an entire class of such models the spectral gap of the generator of the Markov process scales as O(N -2 ). Furthermore, we provide a complete classification of reversible stationary distributions of product type. We demonstrate that our results apply to models similar to the billiard lattice model considered in Gaspard and Gilbert (2009 J. Stat. Mech.: Theory Exp. 2009 24), and hence provide a first step in the derivation of a macroscopic heat equation for a microscopic stochastic evolution of mechanical origin. (paper)

  9. A basic study for the boron thermal regeneration system using anion exchange resins

    International Nuclear Information System (INIS)

    Frantiesek, P.; Kotaka, Masahiro; Okamoto, Makoto; Kakihana, Hidetake.

    1979-01-01

    For the boron thermal regeneration system (BTRS), the basic characteristics of commercial anion exchange resin have been investigated on the swelling characteristics, absorption, desorption and temperature coefficient of exchange capacity for boric acid. The equilibrium capacity increases as decrease of temperature and depends strongly on the degrees of cross linking having a maximum point at about 7% of DVB. The temperature coefficient of equilibrium capacity of boric acid is also a function of the concentration of external solution and of the cross linking having a maximum point around 7% of DVB. (author)

  10. Entropy Exchange in Coupled Field-Superconducting Charge Qubit System with Intrinsic Decoherence

    Institute of Scientific and Technical Information of China (English)

    SHAO Bin; ZHANG Jian; ZOU Jian

    2006-01-01

    Based on the intrinsic decoherence effect, partial entropy properties of a super conducting charge qubitinside a single-mode cavity field is investigated, and entropy exchange which is recently regarded as a kind of anti-correlated behavior of the entropy between subsystems is explored. Our results show that although the intrinsic decoherenceleads to an effective irreversible evolution of the interacting system due to a suppression of coherent quantum features through the decay of off-diagonal matrix elements of the density operator and has an apparently influence on the partial entropy of two individual subsystems, it does not effect the entropy exchange between the two subsystems.

  11. Polarized neutron reflectivity study of a thermally treated MnIr/CoFe exchange bias system.

    Science.gov (United States)

    Awaji, Naoki; Miyajima, Toyoo; Doi, Shuuichi; Nomura, Kenji

    2010-12-01

    It has recently been found that the exchange bias of a MnIr/CoFe system can be increased significantly by adding a thermal treatment to the bilayer. To reveal the origin of the higher exchange bias, we performed polarized neutron reflectivity measurements at the JRR-3 neutron source. The magnetization vector near the MnIr/CoFe interface for thermally treated samples differed from that for samples without the treatment. We propose a model in which the pinned spin area at the interface is extended due to the increased roughness and atomic interdiffusion that result from the thermal treatment.

  12. Analysis of Ion-Exchange Resin Capability of the RSG-GAS Demineralized Water System (GCA01)

    International Nuclear Information System (INIS)

    Diyah Erlina Lestari; Setyo Budi Utomo; Harsono

    2012-01-01

    The Demineralized water system (GCA01) is a system which is function to process raw water to be demineralized water using ion exchange resin unit consisting of a column of cation exchange resins, anion exchange resin column and the column resin mix bed. After certain time the ion exchange resins to be saturated so that is needed regeneration. The RSG-GAS demineralized water system (GCA01) not operated continuously and indication of when does an ion exchange resin regeneration on The RSG-GAS demineralized water system (GCA01) is the water conductivity from anion exchange resin column output indicates ≥ 5μS/cm. Analysis of capability of the ion exchange resin demineralized water system (GCA01) line I has been performed. The analysis was done by comparing the time required in the system operating cycle of regeneration to the next regeneration during the period 2011 and 2012. From the results of the analysis showed the cycle regeneration time is varies. This shows that ion exchange resin capability of the RSG-GAS demineralized water system (GCA01) is varies depending on the raw water quality and success of the regeneration ion exchange resin. (author)

  13. Selection of engineering materials for heat exchangers (An expert system approach)

    International Nuclear Information System (INIS)

    Ahmed, K.; Abou-Ali, M.; Bassuni, M.

    1997-01-01

    The materials selection as a part of the design process of the heat exchangers is one of the most important steps in the whole industry. The clear recognition of the service requirements of the different types of the heat exchangers is very important to select the adequate and economic materials to meet such requirements. of course the manufacturer should ensure that failure does not occur in service specially it is one of the main and fetal component of the nuclear reactor, pressurized water type (PWR). It is necessary to know the possible mechanisms of failure. Also the achievement of the materials selection using the expert system approach in the process sequence of heat exchanger manufacturing is introduced. Different parameters and requirements controlling each process and the linkage between these parameters and the final product will be shown. 2 figs., 3 tabs

  14. Activity systems modeling as a theoretical lens for social exchange studies

    Directory of Open Access Journals (Sweden)

    Ernest Jones

    2016-01-01

    Full Text Available The social exchange perspective seeks to acknowledge, understand and predict the dynamics of social interactions. Empirical research involving social exchange constructs have grown to be highly technical including confirmatory factor analysis to assess construct distinctiveness and structural equation modeling to assess construct causality. Each study seemingly strives to assess how underlying social exchange theoretic constructs interrelate. Yet despite this methodological depth and resultant explanatory and predictive power, a significant number of studies report findings that, once synthesized, suggest an underlying persistent threat of conceptual or construct validity brought about by a search for epistemological parsimony. Further, it is argued that a methodological approach that embraces inherent complexity such as activity systems modeling facilitates the search for simplified models while not ignoring contextual factors.

  15. Nonlocal exchange and kinetic-energy density functionals for electronic systems

    International Nuclear Information System (INIS)

    Glossman, M.D.; Rubio, A.; Balbas, L.C.; Alonso, J.A.

    1992-01-01

    The nonlocal weighted density approximation (WDA) to the exchange and kinetic-energy functionals of many electron systems proposed several years ago by Alonso and Girifalco is used to compute, within the framework of density functional theory, the ground-state electronic density and total energy of noble gas atoms and of neutral jellium-like sodium clusters containing up to 500 atoms. These results are compared with analogous calculations using the well known Thomas-Fermi-Weizsacker-Dirac (TFWD) approximations for the kinetic (TFW) and exchange (D) energy density functionals. An outstanding improvement of the total and exchange energies, of the density at the nucleus and of the expectation values is obtained for atoms within the WDA scheme. For sodium clusters the authors notice a sizeable contribution of the nonlocal effects to the total energy and to the density profiles. In the limit of very large clusters these effects should affect the surface energy of the bulk metal

  16. Automated ion-exchange system for the radiochemical separation of the noble metals

    International Nuclear Information System (INIS)

    Parry, S.J.

    1980-01-01

    Ion-exchange separation is particularly suitable for mechanisation and automated ion exchange has been applied to the activation analysis of biological and environmental samples. In this work a system has been designed for experimental studies, which can be adapted for different modes of operation. The equipment is based on a large-volume sampler for the automatic presentation of 500 ml of liquid to a sampling probe. The sample is delivered to the ion-exchange column by means of a peristaltic pump. The purpose of this work was to automate a procedure for separating the noble metals from irradiated geological samples, for neutron-activation analysis. The process of digesting the rock sample is carried out manually in 30 min and is not suited to unattended operation. The volume of the resulting liquid sample may be 100 ml and so the manual separation step may take as long as 1.25 h per sample. The reason for automating this part of the procedure is to reduce the separation time for a group of five samples and consequently to improve the sensitivity of the analysis for radionuclides with short half-lives. This paper describes the automatic ion-exchange system and the ways in which it can be used. The mode of operation for the separation of the noble metals is given in detail. The reproducibility of the system has been assessed by repeated measurements on a standard reference matte. (author)

  17. A novel electrochemical ion exchange system and its application in water treatment.

    Science.gov (United States)

    Li, Yansheng; Li, Yongbin; Liu, Zhigang; Wu, Tao; Tian, Ying

    2011-06-01

    A novel electrochemical ion exchange system with porous cylinder electrodes is proposed for treatment of wastewater. This system can be used for desalination without the costly ion-exchange membrane and extra chemical reagents. Since the electrodes are completely uniform and no ion-exchange membrane was used in this system, it can be operated by switching anodes and cathodes flexibly for eliminating the scaling on the surface of electrodes. The strong base ion-exchange resin grains placed among the anode and cathode have played as supporting electrolyte, which is capable for the treatment of wastewater with low conductivity. The concentrated and neutralized anolyte containing chlorine is effective for disinfection and contaminants removal. Under the experimental conditions, the removal percentage of total dissolved salts was 83% and the removal percentage of chemical oxygen demand was 92% without consumption of extra chemical reagents. Copyright © 2011 The Research Centre for Eco-Environmental Sciences, Chinese Academy of Sciences. Published by Elsevier B.V. All rights reserved.

  18. Characterizing volumetric discontinuities present in NPP heat exchangers with EASY: an eddy current data analysis system

    International Nuclear Information System (INIS)

    Alencar, Donizete A.; Silva Junior, Silverio F.

    2011-01-01

    Eddy current is a very important NDT inspection method widely used to perform integrity evaluation of tubes installed in heat exchangers. For nuclear power plants, a classical example is the remote inspection of steam generators and condensers, as well as other ordinary auxiliary equipment. Data evaluation can be performed by means of precise phase and amplitude measurements of complex impedance signals, represented as Lissajous figures plotted on the screen of the inspection systems. This paper presents the software EASY, a computer assisted analysis system developed at CDTN to help the characterization of volumetric discontinuities present in heat exchangers tubes. Data to be analyzed are obtained from commercial eddy current equipment data file, such as ECT MAD8D. Main advantage of that system is its portability and easy use, since it can be executed in ordinary PC, under Microsoft Windows operating system. (author)

  19. Characterizing volumetric discontinuities present in NPP heat exchangers with EASY: an eddy current data analysis system

    Energy Technology Data Exchange (ETDEWEB)

    Alencar, Donizete A.; Silva Junior, Silverio F., E-mail: daa@cdtn.b, E-mail: silvasf@cdtn.b [Centro de Desenvolvimento da Tecnologia Nuclear (CDTN/CNEN-MG), Belo Horizonte, MG (Brazil)

    2011-07-01

    Eddy current is a very important NDT inspection method widely used to perform integrity evaluation of tubes installed in heat exchangers. For nuclear power plants, a classical example is the remote inspection of steam generators and condensers, as well as other ordinary auxiliary equipment. Data evaluation can be performed by means of precise phase and amplitude measurements of complex impedance signals, represented as Lissajous figures plotted on the screen of the inspection systems. This paper presents the software EASY, a computer assisted analysis system developed at CDTN to help the characterization of volumetric discontinuities present in heat exchangers tubes. Data to be analyzed are obtained from commercial eddy current equipment data file, such as ECT MAD8D. Main advantage of that system is its portability and easy use, since it can be executed in ordinary PC, under Microsoft Windows operating system. (author)

  20. Effects of Picture Exchange Communication System on Communication and Behavioral Anomalies in Autism

    OpenAIRE

    Malhotra, Shahzadi; Rajender, Gaurav; Bhatia, Manjeet S.; Singh, Tej B.

    2010-01-01

    Communication skills deficits and stereotyped behaviors are frequently found among people with pervasive developmental disabilities like autism. These communication and behavioral oddities of autism are often considered to be difficult to treat and are challenging. Picture exchange communication system (PECS) is a six-phase picture system based on applied behavior analysis and is specially designed to overcome these communication difficulties in children with autism by encouraging the child t...

  1. Virtual screening with AutoDock Vina and the common pharmacophore engine of a low diversity library of fragments and hits against the three allosteric sites of HIV integrase: participation in the SAMPL4 protein-ligand binding challenge.

    Science.gov (United States)

    Perryman, Alexander L; Santiago, Daniel N; Forli, Stefano; Martins, Diogo Santos; Olson, Arthur J

    2014-04-01

    To rigorously assess the tools and protocols that can be used to understand and predict macromolecular recognition, and to gain more structural insight into three newly discovered allosteric binding sites on a critical drug target involved in the treatment of HIV infections, the Olson and Levy labs collaborated on the SAMPL4 challenge. This computational blind challenge involved predicting protein-ligand binding against the three allosteric sites of HIV integrase (IN), a viral enzyme for which two drugs (that target the active site) have been approved by the FDA. Positive control cross-docking experiments were utilized to select 13 receptor models out of an initial ensemble of 41 different crystal structures of HIV IN. These 13 models of the targets were selected using our new "Rank Difference Ratio" metric. The first stage of SAMPL4 involved using virtual screens to identify 62 active, allosteric IN inhibitors out of a set of 321 compounds. The second stage involved predicting the binding site(s) and crystallographic binding mode(s) for 57 of these inhibitors. Our team submitted four entries for the first stage that utilized: (1) AutoDock Vina (AD Vina) plus visual inspection; (2) a new common pharmacophore engine; (3) BEDAM replica exchange free energy simulations, and a Consensus approach that combined the predictions of all three strategies. Even with the SAMPL4's very challenging compound library that displayed a significantly lower amount of structural diversity than most libraries that are conventionally employed in prospective virtual screens, these approaches produced hit rates of 24, 25, 34, and 27 %, respectively, on a set with 19 % declared binders. Our only entry for the second stage challenge was based on the results of AD Vina plus visual inspection, and it ranked third place overall according to several different metrics provided by the SAMPL4 organizers. The successful results displayed by these approaches highlight the utility of the computational

  2. Virtual screening with AutoDock Vina and the common pharmacophore engine of a low diversity library of fragments and hits against the three allosteric sites of HIV integrase: participation in the SAMPL4 protein-ligand binding challenge

    Science.gov (United States)

    Perryman, Alexander L.; Santiago, Daniel N.; Forli, Stefano; Santos-Martins, Diogo; Olson, Arthur J.

    2014-04-01

    To rigorously assess the tools and protocols that can be used to understand and predict macromolecular recognition, and to gain more structural insight into three newly discovered allosteric binding sites on a critical drug target involved in the treatment of HIV infections, the Olson and Levy labs collaborated on the SAMPL4 challenge. This computational blind challenge involved predicting protein-ligand binding against the three allosteric sites of HIV integrase (IN), a viral enzyme for which two drugs (that target the active site) have been approved by the FDA. Positive control cross-docking experiments were utilized to select 13 receptor models out of an initial ensemble of 41 different crystal structures of HIV IN. These 13 models of the targets were selected using our new "Rank Difference Ratio" metric. The first stage of SAMPL4 involved using virtual screens to identify 62 active, allosteric IN inhibitors out of a set of 321 compounds. The second stage involved predicting the binding site(s) and crystallographic binding mode(s) for 57 of these inhibitors. Our team submitted four entries for the first stage that utilized: (1) AutoDock Vina (AD Vina) plus visual inspection; (2) a new common pharmacophore engine; (3) BEDAM replica exchange free energy simulations, and a Consensus approach that combined the predictions of all three strategies. Even with the SAMPL4's very challenging compound library that displayed a significantly lower amount of structural diversity than most libraries that are conventionally employed in prospective virtual screens, these approaches produced hit rates of 24, 25, 34, and 27 %, respectively, on a set with 19 % declared binders. Our only entry for the second stage challenge was based on the results of AD Vina plus visual inspection, and it ranked third place overall according to several different metrics provided by the SAMPL4 organizers. The successful results displayed by these approaches highlight the utility of the computational

  3. The strategic use of standardized information exchange technology in a university health system.

    Science.gov (United States)

    Cheng, Po-Hsun; Chen, Heng-Shuen; Lai, Feipei; Lai, Jin-Shin

    2010-04-01

    This article illustrates a Web-based health information system that is comprised of specific information exchange standards related to health information for healthcare services in National Taiwan University Health System. Through multidisciplinary teamwork, medical and informatics experts collaborated and studied on system scope definition, standard selection challenges, system implementation barriers, system management outcomes, and further expandability of other systems. After user requirement analysis and prototyping, from 2005 to 2008, an online clinical decision support system with multiple functions of reminding and information push was implemented. It was to replace its original legacy systems and serve among the main hospital and three branches of 180-200 clinics and 7,500-8,000 patient visits per day. To evaluate the effectiveness of this system, user surveys were performed, which revealed that the average score of user satisfaction increased from 2.80 to 3.18 on a 4-point scale. Among the items, especially e-learning for training service, courtesy communications for system requests, and courtesy communications for system operations showed statistically significant improvement. From this study, the authors concluded that standardized information exchange technologies can be used to create a brand new enterprise value and steadily obtain more competitive advantages for a prestige healthcare system.

  4. Pressure Pump Power Control in the Primary Circuit of the Heat Exchange System

    Directory of Open Access Journals (Sweden)

    Shilin Aleksandr

    2017-01-01

    Full Text Available In this paper we consider the problem of speed in hot water systems where highly efficient plate heat exchanger is used. Especially marked the problem which is connected with long transition drive of constant speed exceeding the time of the heat exchanger accumulative tank emptying more than twice. As a regulating element in the heat exchange system there was proposed to use asynchronous electric drive of pressure pump in the primary circuit of the heat exchanger. For correct use of such electric drive we solved the problem of control object mathematical model synthesis, which has non-linear properties, in particular, the transfer coefficient of the circuit can vary in more than 6 times. At the same time there was revealed the dependence of the transfer coefficient on the motor speed, which must be considered in the controller synthesis. In conclusion we suggested the solutions of regulators synthesis tasks with customizable settings for speed and switchable structure between relay λ and PI regulators.

  5. Ranking docking poses by graph matching of protein-ligand interactions: lessons learned from the D3R Grand Challenge 2

    Science.gov (United States)

    da Silva Figueiredo Celestino Gomes, Priscila; Da Silva, Franck; Bret, Guillaume; Rognan, Didier

    2018-01-01

    A novel docking challenge has been set by the Drug Design Data Resource (D3R) in order to predict the pose and affinity ranking of a set of Farnesoid X receptor (FXR) agonists, prior to the public release of their bound X-ray structures and potencies. In a first phase, 36 agonists were docked to 26 Protein Data Bank (PDB) structures of the FXR receptor, and next rescored using the in-house developed GRIM method. GRIM aligns protein-ligand interaction patterns of docked poses to those of available PDB templates for the target protein, and rescore poses by a graph matching method. In agreement with results obtained during the previous 2015 docking challenge, we clearly show that GRIM rescoring improves the overall quality of top-ranked poses by prioritizing interaction patterns already visited in the PDB. Importantly, this challenge enables us to refine the applicability domain of the method by better defining the conditions of its success. We notably show that rescoring apolar ligands in hydrophobic pockets leads to frequent GRIM failures. In the second phase, 102 FXR agonists were ranked by decreasing affinity according to the Gibbs free energy of the corresponding GRIM-selected poses, computed by the HYDE scoring function. Interestingly, this fast and simple rescoring scheme provided the third most accurate ranking method among 57 contributions. Although the obtained ranking is still unsuitable for hit to lead optimization, the GRIM-HYDE scoring scheme is accurate and fast enough to post-process virtual screening data.

  6. Severe Acute Respiratory Syndrome-Coronavirus Papain-Like Novel Protease Inhibitors: Design, Synthesis, Protein-Ligand X-ray Structure and Biological Evaluation

    Energy Technology Data Exchange (ETDEWEB)

    Ghosh, Arun K.; Takayama, Jun; Rao, Kalapala Venkateswar; Ratia, Kiira; Chaudhuri, Rima; Mulhearn, Debbie C.; Lee, Hyun; Nichols, Daniel B.; Baliji, Surendranath; Baker, Susan C.; Johnson, Michael E.; Mesecar, Andrew D. (Purdue); (UC); (UIC)

    2012-02-21

    The design, synthesis, X-ray crystal structure, molecular modeling, and biological evaluation of a series of new generation SARS-CoV PLpro inhibitors are described. A new lead compound 3 (6577871) was identified via high-throughput screening of a diverse chemical library. Subsequently, we carried out lead optimization and structure-activity studies to provide a series of improved inhibitors that show potent PLpro inhibition and antiviral activity against SARS-CoV infected Vero E6 cells. Interestingly, the (S)-Me inhibitor 15h (enzyme IC{sub 50} = 0.56 {mu}M; antiviral EC{sub 50} = 9.1 {mu}M) and the corresponding (R)-Me 15g (IC{sub 50} = 0.32 {mu}M; antiviral EC{sub 50} = 9.1 {mu}M) are the most potent compounds in this series, with nearly equivalent enzymatic inhibition and antiviral activity. A protein-ligand X-ray structure of 15g-bound SARS-CoV PLpro and a corresponding model of 15h docked to PLpro provide intriguing molecular insight into the ligand-binding site interactions.

  7. CONAN—The cruncher of local exchange coefficients for strongly interacting confined systems in one dimension

    DEFF Research Database (Denmark)

    Loft, Niels Jakob Søe; Kristensen, Lasse Bjørn; Thomsen, Anders

    2016-01-01

    We consider a one-dimensional system of particles with strong zero-range interactions. This system can be mapped onto a spin chain of the Heisenberg type with exchange coefficients that depend on the external trap. In this paper, we present an algorithm that can be used to compute these exchange...... coefficients. We introduce an open source code CONAN (Coefficients of One-dimensional N-Atom Networks) which is based on this algorithm. CONAN works with arbitrary external potentials and we have tested its reliability for system sizes up to around 35 particles. As illustrative examples, we consider a harmonic...... trap and a box trap with a superimposed asymmetric tilted potential. For these examples, the computation time typically scales with the number of particles as O(N3.5±0.4). Computation times are around 10 s for N=10 particles and less than 10 min for N=20 particles....

  8. Exact exchange-correlation potentials of singlet two-electron systems

    Science.gov (United States)

    Ryabinkin, Ilya G.; Ospadov, Egor; Staroverov, Viktor N.

    2017-10-01

    We suggest a non-iterative analytic method for constructing the exchange-correlation potential, v XC ( r ) , of any singlet ground-state two-electron system. The method is based on a convenient formula for v XC ( r ) in terms of quantities determined only by the system's electronic wave function, exact or approximate, and is essentially different from the Kohn-Sham inversion technique. When applied to Gaussian-basis-set wave functions, the method yields finite-basis-set approximations to the corresponding basis-set-limit v XC ( r ) , whereas the Kohn-Sham inversion produces physically inappropriate (oscillatory and divergent) potentials. The effectiveness of the procedure is demonstrated by computing accurate exchange-correlation potentials of several two-electron systems (helium isoelectronic series, H2, H3 + ) using common ab initio methods and Gaussian basis sets.

  9. Evaluation of heat exchange performance for the auxiliary component cooling water system cooling tower in HTTR

    International Nuclear Information System (INIS)

    Tochio, Daisuke; Kameyama, Yasuhiko; Shimizu, Atsushi; Inoi, Hiroyuki; Yamazaki, Kazunori; Shimizu, Yasunori; Aragaki, Etsushi; Ota, Yukimaru; Fujimoto, Nozomu

    2006-09-01

    The auxiliary component cooling water system (ACCWS) is one of the cooling system in High Temperature Engineering Test Reactor (HTTR). The ACCWS has main two features, many facilities cooling, and heat sink of the vessel cooling system which is one of the engineering safety features. Therefore, the ACCWS is required to satisfy the design criteria of heat removal performance. In this report, heat exchange performance data of the rise-to-power-up test and the in-service operation for the ACCWS cooling tower was evaluated. Moreover, the evaluated values were compared with the design values, and it is confirmed that ACCWS cooling tower has the required heat exchange performance in the design. (author)

  10. Simulation of embedded heat exchangers of solar aided ground source heat pump system

    Institute of Scientific and Technical Information of China (English)

    王芳; 郑茂余; 邵俊鹏; 李忠建

    2008-01-01

    Aimed at unbalance of soil temperature field of ground source heat pump system, solar aided energy storage system was established. In solar assisted ground-source heat pump (SAGSHP) system with soil storage, solar energy collected in three seasons was stored in the soil by vertical U type soil exchangers. The heat abstracted by the ground-source heat pump and collected by the solar collector was employed to heating. Some of the soil heat exchangers were used to store solar energy in the soil so as to be used in next winter after this heating period; and the others were used to extract cooling energy directly in the soil by circulation pump for air conditioning in summer. After that solar energy began to be stored in the soil and ended before heating period. Three dimensional dynamic numerical simulations were built for soil and soil heat exchanger through finite element method. Simulation was done in different strata month by month. Variation and restoration of soil temperature were studied. Economy and reliability of long term SAGSHP system were revealed. It can be seen that soil temperature is about 3 ℃ higher than the original one after one year’s running. It is beneficial for the system to operate for long period.

  11. The exchange of radiotherapy data as part of an electronic patient-referral system

    International Nuclear Information System (INIS)

    Lomax, Antony; Grossmann, Martin; Cozzi, Luca; Tercier, Pierre-Alain; Boehringer, Terence; Schneider, Uwe; Logean, Marianne; Volken, Werner; Ratib, Osman; Miralbell, Raymond

    2000-01-01

    Purpose: To describe the implementation and use of an electronic patient-referral system as an aid to the efficient referral of patients to a remote and specialized treatment center. Methods and Materials: A system for the exchange of radiotherapy data between different commercial planning systems and a specially developed planning system for proton therapy has been developed through the use of the PAPYRUS diagnostic image standard as an intermediate format. To ensure the cooperation of the different TPS manufacturers, the number of data sets defined for transfer has been restricted to the three core data sets of CT, VOIs, and three-dimensional dose distributions. As a complement to the exchange of data, network-wide application-sharing (video-conferencing) technologies have been adopted to provide methods for the interactive discussion and assessment of treatments plans with one or more partner clinics. Results: Through the use of evaluation plans based on the exchanged data, referring clinics can accurately assess the advantages offered by proton therapy on a patient-by-patient basis, while the practicality or otherwise of the proposed treatments can simultaneously be assessed by the proton therapy center. Such a system, along with the interactive capabilities provided by video-conferencing methods, has been found to be an efficient solution to the problem of patient assessment and selection at a specialized treatment center, and is a necessary first step toward the full electronic integration of such centers with their remotely situated referral centers

  12. Grating exchange system of independent mirror supported by floating rotary stage

    Science.gov (United States)

    Zhang, Jianhuan; Tao, Jin; Liu, Yan; Nan, Yan

    2015-10-01

    The performance of The Grating Exchange System can satisfy the Thirty Meter Telescope - TMT for astronomical observation WFOS index requirements and satisfy the requirement of accuracy in the grating exchange. It is used to install in the MOBIE and a key device of MOBIE. The Wide Field Optical Spectrograph (WFOS) is one of the three first-light observing capabilities selected by the TMT Science Advisory Committee. The Multi-Object Broadband Imaging Echellette (MOBIE) instrument design concept has been developed to address the WFOS requirements as described in the TMT Science-Based Requirements Document (SRD). The Grating Exchange System uses a new type of separate movement way of three grating devices and a mirror device. Three grating devices with a mirror are able to achieve independence movement. This kind of grating exchange system can effectively solve the problem that the volume of the grating change system is too large and that the installed space of MOBIE instruments is too limit. This system adopts the good stability, high precision of rotary stage - a kind of using air bearing (Air bearing is famous for its ultra-high precision, and can meet the optical accuracy requirement) and rotation positioning feedback gauge turntable to support grating device. And with a kind of device which can carry greater weight bracket fixed on the MOBIE instrument, with two sets of servo motor control rotary stage and the mirror device respectively. And we use the control program to realize the need of exercising of the grating device and the mirror device. Using the stress strain analysis software--SolidWorks for stress and strain analysis of this structure. And then checking the structure of the rationality and feasibility. And prove that this system can realize the positioning precision under different working conditions can meet the requirements of imaging optical grating diffraction efficiency and error by the calculation and optical performance analysis.

  13. Continual Energy Management System of Proton Exchange Membrane Fuel Cell Hybrid Power Electric Vehicles

    Directory of Open Access Journals (Sweden)

    Ren Yuan

    2016-01-01

    Full Text Available Current research status in energy management of Proton Exchange Membrane (PEM fuel cell hybrid power electric vehicles are first described in this paper, and then build the PEMFC/ lithium-ion battery/ ultra-capacitor hybrid system model. The paper analysis the key factors of the continuous power available in PEM fuel cell hybrid power electric vehicle and hybrid power system working status under different driving modes. In the end this paper gives the working flow chart of the hybrid power system and concludes the three items of the system performance analysis.

  14. Experimental study on the effects of the number of heat exchanger modules on thermal characteristics in a premixed combustion system

    International Nuclear Information System (INIS)

    Yu, Byeonghun; Lee, Chang-Eon; Kum, Sung Min; Lee, Seungro

    2016-01-01

    The effects of the number of heat exchanger modules on thermal characteristics were experimentally studied in a premixed combustion system with a cross-flow staggered-tube heat exchanger. The various heat exchanger modules, from 4 to 8, combined with a premixed burner were tested to investigate the performance of the heat exchanger through the surface area of the heat exchanger at various equivalence ratios. Additionally, the performance of the heat exchanger was analyzed by applying entropy generation theory to the heat exchanger system. As a result, although the heat transfer rate increases with the increase of the equivalence ratio, the NOx and CO concentrations also increase due to the increasing flame temperature. In addition, the entropy generation increases with an increase of the equivalence ratio. Furthermore, the heat transfer rate and the effectiveness are increased with the increase of the number of the heat exchanger modules. Also, the effectiveness is sharply increased when the number of the heat exchanger modules is increased from 4 to 5. Consequently, the optimal operating conditions regarding pollutant emission, effectiveness and entropy generation in this experimental range are 0.85 for the equivalence ratio and 8 for the number of heat exchanger modules

  15. Heat transfer analysis of underground U-type heat exchanger of ground source heat pump system.

    Science.gov (United States)

    Pei, Guihong; Zhang, Liyin

    2016-01-01

    Ground source heat pumps is a building energy conservation technique. The underground buried pipe heat exchanging system of a ground source heat pump (GSHP) is the basis for the normal operation of an entire heat pump system. Computational-fluid-dynamics (CFD) numerical simulation software, ANSYS-FLUENT17.0 have been performed the calculations under the working conditions of a continuous and intermittent operation over 7 days on a GSHP with a single-well, single-U and double-U heat exchanger and the impact of single-U and double-U buried heat pipes on the surrounding rock-soil temperature field and the impact of intermittent operation and continuous operation on the outlet water temperature. The influence on the rock-soil temperature is approximately 13 % higher for the double-U heat exchanger than that of the single-U heat exchanger. The extracted energy of the intermittent operation is 36.44 kw·h higher than that of the continuous mode, although the running time is lower than that of continuous mode, over the course of 7 days. The thermal interference loss and quantity of heat exchanged for unit well depths at steady-state condition of 2.5 De, 3 De, 4 De, 4.5 De, 5 De, 5.5 De and 6 De of sidetube spacing are detailed in this work. The simulation results of seven working conditions are compared. It is recommended that the side-tube spacing of double-U underground pipes shall be greater than or equal to five times of outer diameter (borehole diameter: 180 mm).

  16. Building a national electronic medical record exchange system - experiences in Taiwan.

    Science.gov (United States)

    Li, Yu-Chuan Jack; Yen, Ju-Chuan; Chiu, Wen-Ta; Jian, Wen-Shan; Syed-Abdul, Shabbir; Hsu, Min-Huei

    2015-08-01

    There are currently 501 hospitals and about 20,000 clinics in Taiwan. The National Health Insurance (NHI) system, which is operated by the NHI Administration, uses a single-payer system and covers 99.9% of the nation's total population of 23,000,000. Taiwan's NHI provides people with a high degree of freedom in choosing their medical care options. However, there is the potential concern that the available medical resources will be overused. The number of doctor consultations per person per year is about 15. Duplication of laboratory tests and prescriptions are not rare either. Building an electronic medical record exchange system is a good method of solving these problems and of improving continuity in health care. In November 2009, Taiwan's Executive Yuan passed the 'Plan for accelerating the implementation of electronic medical record systems in medical institutions' (2010-2012; a 3-year plan). According to this plan, a patient can, at any hospital in Taiwan, by using his/her health insurance IC card and physician's medical professional IC card, upon signing a written agreement, retrieve all important medical records for the past 6 months from other participating hospitals. The focus of this plan is to establish the National Electronic Medical Record Exchange Centre (EEC). A hospital's information system will be connected to the EEC through an electronic medical record (EMR) gateway. The hospital will convert the medical records for the past 6 months in its EMR system into standardized files and save them on the EMR gateway. The most important functions of the EEC are to generate an index of all the XML files on the EMR gateways of all hospitals, and to provide search and retrieval services for hospitals and clinics. The EEC provides four standard inter-institution EMR retrieval services covering medical imaging reports, laboratory test reports, discharge summaries, and outpatient records. In this system, we adopted the Health Level 7 (HL7) Clinical Document

  17. Effect of Tube Diameter on The Design of Heat Exchanger in Solar Drying system

    Science.gov (United States)

    Husham Abdulmalek, Shaymaa; Khalaji Assadi, Morteza; Al-Kayiem, Hussain H.; Gitan, Ali Ahmed

    2018-03-01

    The drying of agriculture product consumes a huge fossil fuel rates that demand to find an alternative source of sustainable environmental friendly energy such as solar energy. This work presents the difference between using solar heat source and electrical heater in terms of design aspect. A circular-finned tube bank heat exchanger is considered against an electrical heater used as a heat generator to regenerate silica gel in solar assisted desiccant drying system. The impact of tube diameter on the heat transfer area was investigated for both the heat exchanger and the electrical heater. The fin performance was investigated by determining fin effectiveness and fin efficiency. A mathematical model was developed using MATLAB to describe the forced convection heat transfer between hot water supplied by evacuated solar collector with 70 °C and ambient air flow over heat exchanger finned tubes. The results revealed that the increasing of tube diameter augments the heat transfer area of both heat exchanger and electrical heater. The highest of fin efficiency was around 0.745 and the lowest was around 0.687 while the fin effectiveness was found to be around 0.998.

  18. Study of a Coil Heat Exchanger with an Ice Storage System

    Directory of Open Access Journals (Sweden)

    Yan Li

    2017-12-01

    Full Text Available In this study, a coil heat exchanger with an ice storage system is analyzed by theoretical analysis, numerical analysis, and experimental analysis. The dynamic characteristics of ice thickness variation is studied by means of unstable heat conduction theory in cylindrical coordinates, and the change rule of the ice layer thickness is obtained. The computational fluid dynamics method is employed to simulate the flow field and ice melting process of the coil heat exchanger. The effect of the agitator height on the flow characteristics and heat transfer characteristics is investigated. The numerical results show that the turbulence intensity of the fluid near the wall of the heat exchanger is the largest with an agitator height of 80 mm. Furthermore, the process of ice melting is analyzed. The ice on the outer side of the evaporator tube close to the container wall melts faster than the inner side and this agrees well with the experimental result. The experimental study on the process of the operational period and deicing of the coil heat exchanger is conducted and the temperature variation curves are obtained by the arrangement of thermocouples. It is found that the temperature of the evaporating tube increases with increasing height in the process of ice storage.

  19. Communication: Near-locality of exchange and correlation density functionals for 1- and 2-electron systems

    Science.gov (United States)

    Sun, Jianwei; Perdew, John P.; Yang, Zenghui; Peng, Haowei

    2016-05-01

    The uniform electron gas and the hydrogen atom play fundamental roles in condensed matter physics and quantum chemistry. The former has an infinite number of electrons uniformly distributed over the neutralizing positively charged background, and the latter only one electron bound to the proton. The uniform electron gas was used to derive the local spin density approximation to the exchange-correlation functional that undergirds the development of the Kohn-Sham density functional theory. We show here that the ground-state exchange-correlation energies of the hydrogen atom and many other 1- and 2-electron systems are modeled surprisingly well by a different local spin density approximation (LSDA0). LSDA0 is constructed to satisfy exact constraints but agrees surprisingly well with the exact results for a uniform two-electron density in a finite, curved three-dimensional space. We also apply LSDA0 to excited or noded 1-electron densities, where it works less well. Furthermore, we show that the localization of the exact exchange hole for a 1- or 2-electron ground state can be measured by the ratio of the exact exchange energy to its optimal lower bound.

  20. Communication: Near-locality of exchange and correlation density functionals for 1- and 2-electron systems

    Energy Technology Data Exchange (ETDEWEB)

    Sun, Jianwei; Yang, Zenghui; Peng, Haowei [Department of Physics, Temple University, Philadelphia, Pennsylvania 19122 (United States); Perdew, John P. [Department of Physics, Temple University, Philadelphia, Pennsylvania 19122 (United States); Department of Chemistry, Temple University, Philadelphia, Pennsylvania 19122 (United States)

    2016-05-21

    The uniform electron gas and the hydrogen atom play fundamental roles in condensed matter physics and quantum chemistry. The former has an infinite number of electrons uniformly distributed over the neutralizing positively charged background, and the latter only one electron bound to the proton. The uniform electron gas was used to derive the local spin density approximation to the exchange-correlation functional that undergirds the development of the Kohn-Sham density functional theory. We show here that the ground-state exchange-correlation energies of the hydrogen atom and many other 1- and 2-electron systems are modeled surprisingly well by a different local spin density approximation (LSDA0). LSDA0 is constructed to satisfy exact constraints but agrees surprisingly well with the exact results for a uniform two-electron density in a finite, curved three-dimensional space. We also apply LSDA0 to excited or noded 1-electron densities, where it works less well. Furthermore, we show that the localization of the exact exchange hole for a 1- or 2-electron ground state can be measured by the ratio of the exact exchange energy to its optimal lower bound.

  1. Communication: Near-locality of exchange and correlation density functionals for 1- and 2-electron systems

    International Nuclear Information System (INIS)

    Sun, Jianwei; Yang, Zenghui; Peng, Haowei; Perdew, John P.

    2016-01-01

    The uniform electron gas and the hydrogen atom play fundamental roles in condensed matter physics and quantum chemistry. The former has an infinite number of electrons uniformly distributed over the neutralizing positively charged background, and the latter only one electron bound to the proton. The uniform electron gas was used to derive the local spin density approximation to the exchange-correlation functional that undergirds the development of the Kohn-Sham density functional theory. We show here that the ground-state exchange-correlation energies of the hydrogen atom and many other 1- and 2-electron systems are modeled surprisingly well by a different local spin density approximation (LSDA0). LSDA0 is constructed to satisfy exact constraints but agrees surprisingly well with the exact results for a uniform two-electron density in a finite, curved three-dimensional space. We also apply LSDA0 to excited or noded 1-electron densities, where it works less well. Furthermore, we show that the localization of the exact exchange hole for a 1- or 2-electron ground state can be measured by the ratio of the exact exchange energy to its optimal lower bound.

  2. ReFlexIn: a flexible receptor protein-ligand docking scheme evaluated on HIV-1 protease.

    Directory of Open Access Journals (Sweden)

    Simon Leis

    Full Text Available For many targets of pharmaceutical importance conformational changes of the receptor protein are relevant during the ligand binding process. A new docking approach, ReFlexIn (Receptor Flexibility by Interpolation, that combines receptor flexibility with the computationally efficient potential grid representation of receptor molecules has been evaluated on the retroviral HIV-1 (Human Immunodeficiency Virus 1 protease system. An approximate inclusion of receptor flexibility is achieved by using interpolation between grid representations of individual receptor conformations. For the retroviral protease the method was tested on an ensemble of protease structures crystallized in the presence of different ligands and on a set of structures obtained from morphing between the unbound and a ligand-bound protease structure. Docking was performed on ligands known to bind to the protease and several non-binders. For the binders the ReFlexIn method yielded in almost all cases ligand placements in similar or closer agreement with experiment than docking to any of the ensemble members without degrading the discrimination with respect to non-binders. The improved docking performance compared to docking to rigid receptors allows for systematic virtual screening applications at very small additional computational cost.

  3. Factors influencing intentions to use social recommender systems: a social exchange perspective.

    Science.gov (United States)

    Chang, Tsung-Sheng; Hsiao, Wei-Hung

    2013-05-01

    This study employs the perspective of social exchange theory and seeks to understand users' intentions to use social recommender systems (SRS) through three psychological factors: trust, shared values, and reputation. We use structural equation modeling to analyze 221 valid questionnaires. The results show that trust has a direct positive influence on the intention to use SRS, followed by shared values, whereas reputation has an indirect influence on SRS use. We further discuss specific recommendations concerning these factors for developing SRS.

  4. Multiply controlled verbal operants: An analysis and extension to the picture exchange communication system

    OpenAIRE

    Bondy, Andy; Tincani, Matt; Frost, Lori

    2004-01-01

    This paper presents Skinner's (1957) analysis of verbal behavior as a framework for understanding language acquisition in children with autism. We describe Skinner's analysis of pure and impure verbal operants and illustrate how this analysis may be applied to the design of communication training programs. The picture exchange communication system (PECS) is a training program influenced by Skinner's framework. We describe the training sequence associated with PECS and illustrate how this sequ...

  5. The Picture Exchange Communication System and his application of child with autism spectrum disorder

    OpenAIRE

    Kozlová, Veronika

    2011-01-01

    The bachelor thesis with title "The Picture Exchange Communication System and his application of child with autism spectrum disorder", deals with problems in communication of the children with autism spectrum disorders. One of the goals of the thesis is to submit a comprehensive overview of the essential knowledge of autism, history of autism, typical triad of symptoms (characteristic features of children with autism), etiology, and dividing autism by the adaptability. Another goal is to intr...

  6. A Preliminary Analysis of Teaching Improvisation with the Picture Exchange Communication System to Children with Autism

    OpenAIRE

    Marckel, Julie M; Neef, Nancy A; Ferreri, Summer J

    2006-01-01

    Two young boys with autism who used the picture exchange communication system were taught to solve problems (improvise) by using descriptors (functions, colors, and shapes) to request desired items for which specific pictures were unavailable. The results of a multiple baseline across descriptors showed that training increased the number of improvised requests, and that these skills generalized to novel items, and across settings and listeners in the natural environment.

  7. Optimal Sequential Resource Sharing and Exchange in Multi-Agent Systems

    OpenAIRE

    Xiao, Yuanzhang

    2014-01-01

    Central to the design of many engineering systems and social networks is to solve the underlying resource sharing and exchange problems, in which multiple decentralized agents make sequential decisions over time to optimize some long-term performance metrics. It is challenging for the decentralized agents to make optimal sequential decisions because of the complicated coupling among the agents and across time. In this dissertation, we mainly focus on three important classes of multi-agent seq...

  8. Mathematical simulation of equilibria in the Pr(3) chloride-iminodiacetic acid - cation exchange resin system

    Energy Technology Data Exchange (ETDEWEB)

    Kupriyanova, G.N.; Krivenko, S.V.; Martynenko, L.I.; Evseev, A.M.; Spitsyn, V.I. (Moskovskij Gosudarstvennyj Univ. (USSR))

    1982-01-01

    Multiresponse adequate mathematical model is constructed that describes the composition of phases in the complex ion exchange system r.e.e. (PrCl/sub 3/)-complexon (iminodiacetic acid)-cationite-H/sub 2/O-KOH. The model is constructed on the basis of the law of acting masses in combination with equations of material balance and electroneutrality equations. The considerable effect on the state of the sorption system of metal complexonates is proved. The account of absorption of praseodymium iminodiacetates is necessary for complete description of the system and control of chromatographic process.

  9. Analysis and Perspective from the Complex Aerospace Systems Exchange (CASE) 2013

    Science.gov (United States)

    Jones, Kennie H.; Parker, Peter A.; Detweiler, Kurt N.; McGowan, Anna-Maria R.; Dress, David A.; Kimmel, William M.

    2014-01-01

    NASA Langley Research Center embedded four rapporteurs at the Complex Aerospace Systems Exchange (CASE) held in August 2013 with the objective to capture the essence of the conference presentations and discussions. CASE was established to provide a discussion forum among chief engineers, program managers, and systems engineers on challenges in the engineering of complex aerospace systems. The meeting consists of invited presentations and panels from industry, academia, and government followed by discussions among attendees. This report presents the major and reoccurring themes captured throughout the meeting and provides analysis and insights to further the CASE mission.

  10. Exchange Network

    Science.gov (United States)

    The Environmental Information Exchange Network (EN) is an Internet-based system used by state, tribal and territorial partners to securely share environmental and health information with one another and EPA.

  11. Activation energies for iodine-exchange systems containing organic iodine compounds

    Energy Technology Data Exchange (ETDEWEB)

    Ikeda, N. (Takyo Univ. of Education (Japan). Faculty of Science) Takahashi, Yasuko

    1976-01-01

    In studies on the nonequilibrium isotopic exchange method for determining iodine in organic iodine compounds, activation energies have been measured to find systems having appropriate rate of exchange reactions. Activation energies are discussed by considering the effect of the structure of organic iodine compounds, the concentrations of reactants and solvent, etc. In homogeneous systems, activation energy is found to become larger in the order of CH/sub 3/Isystems, e.g. org. I(aq.)--I/sub 2/(CCL/sub 4/ or C/sub 2/H/sub 4/Cl/sub 2/), activation energy increases in the order of 3,5-diiodotyrosine<3-iodotyrosine<5-iodouracil. The catalytic effect of I/sub 2/ is large, and the iodine ratio between I/sub 2/ and organic iodine is a predominant factor in determining the rate of the exchange reaction.

  12. Photolithography and Fluorescence Correlation Spectroscopy used to examine the rates of exchange in reverse micelle systems

    Science.gov (United States)

    Norris, Zach; Mawson, Cara; Johnson, Kyron; Kessler, Sarah; Rebecca, Anne; Wolf, Nathan; Lim, Michael; Nucci, Nathaniel

    Reverse micelles are molecular complexes that encapsulate a nanoscale pool of water in a surfactant shell dissolved in non-polar solvent. These complexes have a wide range of applications, and in all cases, the degree to which reverse micelles (RM) exchange their contents is relevant for their use. Despite its importance, this aspect of RM behavior is poorly understood. Photolithography is employed here to create micro and nano scale fluidic systems in which mixing rates can be precisely measured using fluorescence correlation spectroscopy (FCS). Micro-channel patterns are etched using reactive ion etching process into a layer of silicon dioxide on crystalline silicon substrates. Solutions containing mixtures of reverse micelles, proteins, and fluorophores are placed into reservoirs in the patterns, while diffusion and exchange between RMs is monitored using a FCS system built from a modified confocal Raman spectrometer. Using this approach, the diffusion and exchange rates for RM systems are measured as a function of the components of the RM mixture. Funding provided by Rowan University.

  13. Development of a system using the library of the Genie spectroscopy software and exchange of samples

    International Nuclear Information System (INIS)

    Lapolli, Andre L.; Munita, Casimiro S.

    2011-01-01

    One the great difficulties in using the NAA method is in regards to the time that the operator spends exchanging the samples after each measurement. It becomes a big problem in routine analyses when various chemical elements are determined and then each sample must be measured at different decay times. The application of the automatic sample exchanger reduces the time analysis by several hours and reduces the tedious manual operation. Then, the effective use of NAA depends on the availability of a suitable automatic sample changer. There are some systems that are sold commercially, however many laboratories can not acquire them because they are costly. This paper presents altered programs the G2KNAA.REX, which created a screen making possible automatic or manual acquisitions by calling the old program NAAACQ.rex for the procurement manual and the new program NAAACQ2.rex for automatic requisitions. In conclusion, as can be seen in the program lines, the synchronization to automation, which unites the three systems (the computer, the Canberra Set, the sample exchanger) is done in a timely manner. The system was tested and is functioning in a satisfactory manner. (author)

  14. Risk management and market efficiency on the Midwest Independent System Operator electricity exchange

    Science.gov (United States)

    Jones, Kevin

    Midwest Independent Transmission System Operator, Inc. (MISO) is a non-profit regional transmission organization (RTO) that oversees electricity production and transmission across thirteen states and one Canadian province. MISO also operates an electronic exchange for buying and selling electricity for each of its five regional hubs. MISO oversees two types of markets. The forward market, which is referred to as the day-ahead (DA) market, allows market participants to place demand bids and supply offers on electricity to be delivered at a specified hour the following day. The equilibrium price, known as the locational marginal price (LMP), is determined by MISO after receiving sale offers and purchase bids from market participants. MISO also coordinates a spot market, which is known as the real-time (RT) market. Traders in the real-time market must submit bids and offers by thirty minutes prior to the hour for which the trade will be executed. After receiving purchase and sale offers for a given hour in the real time market, MISO then determines the LMP for that particular hour. The existence of the DA and RT markets allows producers and retailers to hedge against the large fluctuations that are common in electricity prices. Hedge ratios on the MISO exchange are estimated using various techniques. No hedge ratio technique examined consistently outperforms the unhedged portfolio in terms of variance reduction. Consequently, none of the hedge ratio methods in this study meet the general interpretation of FASB guidelines for a highly effective hedge. One of the major goals of deregulation is to bring about competition and increased efficiency in electricity markets. Previous research suggests that electricity exchanges may not be weak-form market efficient. A simple moving average trading rule is found to produce statistically and economically significant profits on the MISO exchange. This could call the long-term survivability of the MISO exchange into question.

  15. Spin-exchange and spin-destruction rates for the 3He-Na system

    International Nuclear Information System (INIS)

    Borel, P.I.; Soegaard, L.V.; Svendsen, W.E.; Andersen, N.

    2003-01-01

    Optically pumped Na is used as a spin-exchange partner to polarize 3 He. Polarizations around 20% have routinely been achieved in sealed spherical glass cells containing 3 He, N 2 , and a few droplets of Na. An optical technique has been developed to determine the Na- 3 He spin-exchange rate coefficient. By monitoring the Na spin relaxation ''in the dark,'' the average Na-Na spin-destruction cross section at 330 degree sign C is estimated to be around 5x10 -19 cm 2 . This value is 2-5 (15-30) times smaller than the previously reported values for the K-K (Rb-Rb) spin-relaxation cross section. In the temperature range 310-355 degree sign C the spin-exchange rate coefficient is found to be (6.1±0.6)x10 -20 cm 3 /s with no detectable temperature dependence. This value is in good agreement with a previous theoretical estimate reported by Walker and it is only slightly lower than the corresponding Rb- 3 He spin-exchange rate coefficient. The total Na- 3 He spin-destruction rate coefficient is, within errors, found to be the same as the Na- 3 He spin-exchange rate coefficient, thereby indicating that the maximum possible photon efficiency may approach unity for the Na- 3 He system. A technique, in which a charge-coupled device camera is used to take images of faint unquenched fluorescence light, has been utilized to allow for an instantaneous determination of the sodium number densities during the rate coefficient measurements

  16. Modelling fireside corrosion of heat exchangers in co-fired pulverised fuel power systems

    Energy Technology Data Exchange (ETDEWEB)

    Simms, N.J. [Cranfield Univ. (United Kingdom). Energy Technology Centre; Fry, A.T. [National Physical Laboratory, Teddington, Middlesex (United Kingdom)

    2010-07-01

    As a result of concerns about the effects of CO{sub 2} emissions on the global environment, there is increasing pressure to reduce such emissions from power generation systems. The use of biomass co-firing with coal in conventional pulverised fuel power stations has provided the most immediate route to introduce a class of fuel that is regarded as both sustainable and carbon neutral. In the future it is anticipated that increased levels of biomass will need to be used in such systems to achieve the desired CO{sub 2} emission targets. However there are concerns over the risk of fireside corrosion damage to the various heat exchangers and boiler walls used in such systems. Future pulverised fuel power systems will need to be designed to cope with the effects of using a wide range of coal-biomass mixes. However, such systems will also need to use much higher heat exchanger operating temperatures to increase their conversion efficiencies and counter the effects of the CO{sub 2} capture technologies that will need to be used in them. Higher operating temperatures will also increase the risk of fireside corrosion damage to the critical heat exchangers. This paper reports work that has been carried out to develop quantitative corrosion models for heat exchangers in pulverised fuel power systems. These developments have been particularly targeted at producing models that enable the evaluation of the effects of using different coal-biomass mixtures and of increasing heat exchanger operating conditions. Models have been produced that have been targeted at operating conditions and materials used in (a) superheaters/reheaters and (b) waterwalls. Data used in the development of these models has been produced from full scale and pilot scale plants in the UK using a wide range of coal and biomass mixtures, as well as from carefully targeted series of laboratory corrosion tests. Mechanistic and neural network based models have been investigated during this development process to

  17. Enhanced exchange anisotropy in IrMn/CoFeB systems and its correlation with uncompensated interfacial spins

    DEFF Research Database (Denmark)

    Du, Yuqing; Pan, Genhua; Moate, Roy

    2010-01-01

    Bottom pinned exchange bias systems of IrMn/CoFe and IrMn/CoFeB on CoFe seed layers were studied. Enhanced exchange anisotropy has been observed for IrMn/CoFeB samples annealed at 350 °C. The ferromagnetic and antiferromagnetic layers of both samples are polycrystalline and textured {110} for the...

  18. [Problems encountered by hospital pharmacists with information systems: Analysis of exchanges within social networks].

    Science.gov (United States)

    Charpiat, B; Mille, F; Fombeur, P; Machon, J; Zawadzki, E; Bobay-Madic, A

    2018-05-21

    The development of information systems in French hospitals is mandatory. The aim of this work was to analyze the content of exchanges carried out within social networks, dealing with problems encountered with hospital pharmacies information systems. Messages exchanged via the mailing list of the Association pour le Digital et l'Information en Pharmacie and abstracts of communications presented at hospital pharmacists trade union congresses were analyzed. Those referring to information systems used in hospital pharmacies were selected. From March 2015 to June 2016, 122 e-mails sent by 80 pharmacists concerned information systems. From 2002 to 2016, 45 abstracts dealt with this topic. Problems most often addressed in these 167 documents were "parameterization and/or functionalities" (n=116), interfaces and complexity of the hospital information systems (n=52), relationship with health information technologies vendors and poor reactivity (n=32), additional workload (n=32), ergonomics (n=30), insufficient user training (n=22). These problems are interdependent, lead to errors and in order to mitigate their consequences, they compel pharmacy professionals to divert a significant amount of working hours to the detriment of pharmaceutical care and dispensing and preparing drugs. Hospital pharmacists are faced with many problems of insecurity and inefficiency generated by information systems. Researches are warranted to determine their cost, specify their deleterious effects on care and identify the safest information systems. Copyright © 2018 Académie Nationale de Pharmacie. Published by Elsevier Masson SAS. All rights reserved.

  19. Working parameters affecting earth-air heat exchanger (EAHE) system performance for passive cooling: A review

    Science.gov (United States)

    Darius, D.; Misaran, M. S.; Rahman, Md. M.; Ismail, M. A.; Amaludin, A.

    2017-07-01

    The study on the effect of the working parameters such as pipe material, pipe length, pipe diameter, depth of burial of the pipe, air flow rate and different types of soils on the thermal performance of earth-air heat exchanger (EAHE) systems is very crucial to ensure that thermal comfort can be achieved. In the past decade, researchers have performed studies to develop numerical models for analysis of EAHE systems. Until recently, two-dimensional models replaced the numerical models in the 1990s and in recent times, more advanced analysis using three-dimensional models, specifically the Computational Fluid Dynamics (CFD) simulation in the analysis of EAHE system. This paper reviews previous models used to analyse the EAHE system and working parameters that affects the earth-air heat exchanger (EAHE) thermal performance as of February 2017. Recent findings on the parameters affecting EAHE performance are also presented and discussed. As a conclusion, with the advent of CFD methods, investigational work have geared up to modelling and simulation work as it saves time and cost. Comprehension of the EAHE working parameters and its effect on system performance is largely established. However, the study on type of soil and its characteristics on the performance of EAHEs systems are surprisingly barren. Therefore, future studies should focus on the effect of soil characteristics such as moisture content, density of soil, and type of soil on the thermal performance of EAHEs system.

  20. Predicting binding poses and affinities for protein - ligand complexes in the 2015 D3R Grand Challenge using a physical model with a statistical parameter estimation

    Science.gov (United States)

    Grudinin, Sergei; Kadukova, Maria; Eisenbarth, Andreas; Marillet, Simon; Cazals, Frédéric

    2016-09-01

    The 2015 D3R Grand Challenge provided an opportunity to test our new model for the binding free energy of small molecules, as well as to assess our protocol to predict binding poses for protein-ligand complexes. Our pose predictions were ranked 3-9 for the HSP90 dataset, depending on the assessment metric. For the MAP4K dataset the ranks are very dispersed and equal to 2-35, depending on the assessment metric, which does not provide any insight into the accuracy of the method. The main success of our pose prediction protocol was the re-scoring stage using the recently developed Convex-PL potential. We make a thorough analysis of our docking predictions made with AutoDock Vina and discuss the effect of the choice of rigid receptor templates, the number of flexible residues in the binding pocket, the binding pocket size, and the benefits of re-scoring. However, the main challenge was to predict experimentally determined binding affinities for two blind test sets. Our affinity prediction model consisted of two terms, a pairwise-additive enthalpy, and a non pairwise-additive entropy. We trained the free parameters of the model with a regularized regression using affinity and structural data from the PDBBind database. Our model performed very well on the training set, however, failed on the two test sets. We explain the drawback and pitfalls of our model, in particular in terms of relative coverage of the test set by the training set and missed dynamical properties from crystal structures, and discuss different routes to improve it.

  1. Exergoeconomic analysis of vehicular PEM (proton exchange membrane) fuel cell systems with and without expander

    International Nuclear Information System (INIS)

    Sayadi, Saeed; Tsatsaronis, George; Duelk, Christian

    2014-01-01

    In this paper we perform an exergoeconomic analysis to a PEM (proton exchange membrane) vehicular fuel cell system used in the latest generation of environmentally friendly cars. Two alternative configurations of a fuel cell system are considered (with and without an expander), and two alternative design concepts for each configuration: BoL (Begin of Life) and EoL (End of Life). The system including an expander generates additional power from the exhaust gases leaving the fuel cell stack, which might increase the system efficiency. However the total investment costs for this case are higher than for the other system configuration without an expander, due to the investment costs associated with the expander and its accessories. The fuel cell stack area in the EoL-sized systems is larger than in the BoL-sized systems. A larger stack area on one hand raises the investment costs, but on the other hand decreases the fuel consumption due to a higher cell efficiency. In this paper, exergoeconomic analyses have been implemented to consider a trade-off between positive and negative effects of using an expander in the system and to select the proper design concept. The results from the exergoeconomic analysis show that (a) an EoL-sized system with an expander is the most cost effective system, (b) the compression and humidification of air are very expensive processes, (c) the stack is by far the most important component from the economic viewpoint, and (d) the thermodynamic efficiency of almost all components must be improved to increase the cost effectiveness of the overall system. - Highlights: • Two vehicular PEM (proton exchange membrane) fuel cell system configurations are studied in this paper. • Exergoeconomics has been performed to compare these two system configurations. • The compression and humidification of air are very expensive processes. • The stack is by far the most important component from the economic viewpoint. • The thermodynamic efficiencies

  2. Design and analysis of heat exchanger networks for integrated Ca-looping systems

    International Nuclear Information System (INIS)

    Lara, Yolanda; Lisbona, Pilar; Martínez, Ana; Romeo, Luis M.

    2013-01-01

    Highlights: • Heat integration is essential to minimize energy penalties in calcium looping cycles. • A design and analysis of four heat exchanger networks is stated. • New design with higher power, lower costs and lower destroyed exergy than base case. - Abstract: One of the main challenges of carbon capture and storage technologies deals with the energy penalty associated with CO 2 separation and compression processes. Thus, heat integration plays an essential role in the improvement of these systems’ efficiencies. CO 2 capture systems based on Ca-looping process present a great potential for residual heat integration with a new supercritical power plant. The pinch methodology is applied in this study to define the minimum energy requirements of the process and to design four configurations for the required heat exchanger network. The Second Law of Thermodynamics represents a powerful tool for reducing the energy demand since identifying the exergy losses of the system serves to allocate inefficiencies. In parallel, an economic analysis is required to asses the cost reduction achieved by each configuration. This work presents a combination of pinch methodology with economic and exergetic analyses to select the more appropriate configuration of heat exchanger network. The lower costs and minor destroyed exergy obtained for the best proposed network result in a of 0.91% global energy efficiency increase

  3. Experimental investigation on an integrated thermal management system with heat pipe heat exchanger for electric vehicle

    International Nuclear Information System (INIS)

    Zou, Huiming; Wang, Wei; Zhang, Guiying; Qin, Fei; Tian, Changqing; Yan, Yuying

    2016-01-01

    Highlights: • An integrated thermal management system is proposed for electric vehicle. • The parallel branch of battery chiller can supply additional cooling capacity. • Heat pipe performance on preheating mode is better than that on cooling mode. • Heat pipe heat exchanger is a feasible choice for battery thermal management. - Abstract: An integrated thermal management system combining a heat pipe battery cooling/preheating system with the heat pump air conditioning system is presented to fulfill the comprehensive energy utilization for electric vehicles. A test bench with battery heat pipe heat exchanger and heat pump air conditioning for a regular five-chair electric car is set up to research the performance of this integrated system under different working conditions. The investigation results show that as the system is designed to meet the basic cabinet cooling demand, the additional parallel branch of battery chiller is a good way to solve the battery group cooling problem, which can supply about 20% additional cooling capacity without input power increase. Its coefficient of performance for cabinet heating is around 1.34 at −20 °C out-car temperature and 20 °C in-car temperature. The specific heat of the battery group is tested about 1.24 kJ/kg °C. There exists a necessary temperature condition for the heat pipe heat exchanger to start action. The heat pipe heat transfer performance is around 0.87 W/°C on cooling mode and 1.11 W/°C on preheating mode. The gravity role makes the heat transfer performance of the heat pipe on preheating mode better than that on cooling mode.

  4. Proton exchange in systems: Glucose-water and uric acid-water

    International Nuclear Information System (INIS)

    Maarof, S.

    2007-01-01

    It is clear that formation of glucose-water and uric acid-water solutions is related in principle to interaction accepter - donor between hydrogen atom in water and oxygen atom in glucose or uric acid. The proton exchange in hydrogen bond system is an integral process and it goes by tunnel mechanism (transfer of proton within the hydrogen bridge in these structures). Proton exchange process goes very quickly at low concentrations for glucose and uric acid solutions, because these compounds are able to form more than one hydrogen bond, which helps the proton transfer within obtained structure. However, at its high concentrations, the process becomes very slow due to higher viscosity of its solutions, which result in break down of the structures, and more hydrogen bonds. (author)

  5. The information exchange between moduluses in the system of module programming of the computation complexes

    International Nuclear Information System (INIS)

    Zinin, A.I.; Kolesov, V.E.; Nevinitsa, A.I.

    1975-01-01

    The report contains description of the method of construction of computer programs complexes for computation purposes for M-220 computers using the ALGOL-60 code for programming. The complex is organised on the modulus system principle and can include substantial number of modulus programs. The information exchange between separate moduli is done by means of special interpreting program and the information unit exchanged is a specially arranged file of data. For addressing to the interpreting program in the ALGOL-60 frameworks small number of specially created procedure-codes is used. The method proposed gives possibilities to program separate moduli of the complex independently and to expand the complex if necessary. In this case separate moduli or groups of moduli depending on the method of segmentation of the general problem solved by the complex will be of the independent interest and could be used out of the complex as traditional programs. (author)

  6. Modeling the ion transfer and polarization of ion exchange membranes in bioelectrochemical systems.

    Science.gov (United States)

    Harnisch, Falk; Warmbier, Robert; Schneider, Ralf; Schröder, Uwe

    2009-06-01

    An explicit numerical model for the charge balancing ion transfer across monopolar ion exchange membranes under conditions of bioelectrochemical systems is presented. Diffusion and migration equations have been solved according to the Nernst-Planck Equation and the resulting ion concentrations, pH values and the resistance values of the membrane for different conditions were computed. The modeling results underline the principle limitations of the application of ion exchange membranes in biological fuel cells and electrolyzers, caused by the inherent occurrence of a pH-gradient between anode and cathode compartment, and an increased ohmic membrane resistance at decreasing electrolyte concentrations. Finally, the physical and numerical limitations of the model are discussed.

  7. Fault diagnosis for the heat exchanger of the aircraft environmental control system based on the strong tracking filter.

    Science.gov (United States)

    Ma, Jian; Lu, Chen; Liu, Hongmei

    2015-01-01

    The aircraft environmental control system (ECS) is a critical aircraft system, which provides the appropriate environmental conditions to ensure the safe transport of air passengers and equipment. The functionality and reliability of ECS have received increasing attention in recent years. The heat exchanger is a particularly significant component of the ECS, because its failure decreases the system's efficiency, which can lead to catastrophic consequences. Fault diagnosis of the heat exchanger is necessary to prevent risks. However, two problems hinder the implementation of the heat exchanger fault diagnosis in practice. First, the actual measured parameter of the heat exchanger cannot effectively reflect the fault occurrence, whereas the heat exchanger faults are usually depicted by utilizing the corresponding fault-related state parameters that cannot be measured directly. Second, both the traditional Extended Kalman Filter (EKF) and the EKF-based Double Model Filter have certain disadvantages, such as sensitivity to modeling errors and difficulties in selection of initialization values. To solve the aforementioned problems, this paper presents a fault-related parameter adaptive estimation method based on strong tracking filter (STF) and Modified Bayes classification algorithm for fault detection and failure mode classification of the heat exchanger, respectively. Heat exchanger fault simulation is conducted to generate fault data, through which the proposed methods are validated. The results demonstrate that the proposed methods are capable of providing accurate, stable, and rapid fault diagnosis of the heat exchanger.

  8. Fault diagnosis for the heat exchanger of the aircraft environmental control system based on the strong tracking filter.

    Directory of Open Access Journals (Sweden)

    Jian Ma

    Full Text Available The aircraft environmental control system (ECS is a critical aircraft system, which provides the appropriate environmental conditions to ensure the safe transport of air passengers and equipment. The functionality and reliability of ECS have received increasing attention in recent years. The heat exchanger is a particularly significant component of the ECS, because its failure decreases the system's efficiency, which can lead to catastrophic consequences. Fault diagnosis of the heat exchanger is necessary to prevent risks. However, two problems hinder the implementation of the heat exchanger fault diagnosis in practice. First, the actual measured parameter of the heat exchanger cannot effectively reflect the fault occurrence, whereas the heat exchanger faults are usually depicted by utilizing the corresponding fault-related state parameters that cannot be measured directly. Second, both the traditional Extended Kalman Filter (EKF and the EKF-based Double Model Filter have certain disadvantages, such as sensitivity to modeling errors and difficulties in selection of initialization values. To solve the aforementioned problems, this paper presents a fault-related parameter adaptive estimation method based on strong tracking filter (STF and Modified Bayes classification algorithm for fault detection and failure mode classification of the heat exchanger, respectively. Heat exchanger fault simulation is conducted to generate fault data, through which the proposed methods are validated. The results demonstrate that the proposed methods are capable of providing accurate, stable, and rapid fault diagnosis of the heat exchanger.

  9. Modeling and operation optimization of a proton exchange membrane fuel cell system for maximum efficiency

    International Nuclear Information System (INIS)

    Han, In-Su; Park, Sang-Kyun; Chung, Chang-Bock

    2016-01-01

    Highlights: • A proton exchange membrane fuel cell system is operationally optimized. • A constrained optimization problem is formulated to maximize fuel cell efficiency. • Empirical and semi-empirical models for most system components are developed. • Sensitivity analysis is performed to elucidate the effects of major operating variables. • The optimization results are verified by comparison with actual operation data. - Abstract: This paper presents an operation optimization method and demonstrates its application to a proton exchange membrane fuel cell system. A constrained optimization problem was formulated to maximize the efficiency of a fuel cell system by incorporating practical models derived from actual operations of the system. Empirical and semi-empirical models for most of the system components were developed based on artificial neural networks and semi-empirical equations. Prior to system optimizations, the developed models were validated by comparing simulation results with the measured ones. Moreover, sensitivity analyses were performed to elucidate the effects of major operating variables on the system efficiency under practical operating constraints. Then, the optimal operating conditions were sought at various system power loads. The optimization results revealed that the efficiency gaps between the worst and best operation conditions of the system could reach 1.2–5.5% depending on the power output range. To verify the optimization results, the optimal operating conditions were applied to the fuel cell system, and the measured results were compared with the expected optimal values. The discrepancies between the measured and expected values were found to be trivial, indicating that the proposed operation optimization method was quite successful for a substantial increase in the efficiency of the fuel cell system.

  10. Heat exchanger

    International Nuclear Information System (INIS)

    Leigh, D.G.

    1976-01-01

    The arrangement described relates particularly to heat exchangers for use in fast reactor power plants, in which heat is extracted from the reactor core by primary liquid metal coolant and is then transferred to secondary liquid metal coolant by means of intermediate heat exchangers. One of the main requirements of such a system, if used in a pool type fast reactor, is that the pressure drop on the primary coolant side must be kept to a minimum consistent with the maintenance of a limited dynamic head in the pool vessel. The intermediate heat exchanger must also be compact enough to be accommodated in the reactor vessel, and the heat exchanger tubes must be available for inspection and the detection and plugging of leaks. If, however, the heat exchanger is located outside the reactor vessel, as in the case of a loop system reactor, a higher pressure drop on the primary coolant side is acceptable, and space restriction is less severe. An object of the arrangement described is to provide a method of heat exchange and a heat exchanger to meet these problems. A further object is to provide a method that ensures that excessive temperature variations are not imposed on welded tube joints by sudden changes in the primary coolant flow path. Full constructional details are given. (U.K.)

  11. Control of advanced reactor-coupled heat exchanger system: Incorporation of reactor dynamics in system response to load disturbances

    Energy Technology Data Exchange (ETDEWEB)

    Skavdahi, Isaac; Utgikar, Vivek [Dept. of Chemical and Materials Engineering, University of Idaho, Moscow (United States); Christensen, Richard [Nuclear Engineering Program, University of Idaho, Idaho Falls (United States); Chen, Ming Hui; Sun, Xiao Dong [Nuclear Engineering Program, Department of Mechanical and Aerospace Engineering, The Ohio State University, Columbus (United States); Sabharwall, Piyush [Idaho National Laboratory, Idaho Falls (United States)

    2016-12-15

    Alternative control schemes for an Advanced High Temperature Reactor system consisting of a reactor, an intermediate heat exchanger, and a secondary heat exchanger (SHX) are presented in this paper. One scheme is designed to control the cold outlet temperature of the SHX (T{sub co}) and the hot outlet temperature of the intermediate heat exchanger (Th{sub o2}) by manipulating the hot-side flow rates of the heat exchangers (F{sub h}/F{sub h2}) responding to the flow rate and temperature disturbances. The flow rate disturbances typically require a larger manipulation of the flow rates than temperature disturbances. An alternate strategy examines the control of the cold outlet temperature of the SHX (T{sub co}) only, since this temperature provides the driving force for energy production in the power conversion unit or the process application. The control can be achieved by three options: (1) flow rate manipulation; (2) reactor power manipulation; or (3) a combination of the two. The first option has a quicker response but requires a large flow rate change. The second option is the slowest but does not involve any change in the flow rates of streams. The third option appears preferable as it has an intermediate response time and requires only a minimal flow rate change.

  12. Control of Advanced Reactor-Coupled Heat Exchanger System: Incorporation of Reactor Dynamics in System Response to Load Disturbances

    Directory of Open Access Journals (Sweden)

    Isaac Skavdahl

    2016-12-01

    Full Text Available Alternative control schemes for an Advanced High Temperature Reactor system consisting of a reactor, an intermediate heat exchanger, and a secondary heat exchanger (SHX are presented in this paper. One scheme is designed to control the cold outlet temperature of the SHX (Tco and the hot outlet temperature of the intermediate heat exchanger (Tho2 by manipulating the hot-side flow rates of the heat exchangers (Fh/Fh2 responding to the flow rate and temperature disturbances. The flow rate disturbances typically require a larger manipulation of the flow rates than temperature disturbances. An alternate strategy examines the control of the cold outlet temperature of the SHX (Tco only, since this temperature provides the driving force for energy production in the power conversion unit or the process application. The control can be achieved by three options: (1 flow rate manipulation; (2 reactor power manipulation; or (3 a combination of the two. The first option has a quicker response but requires a large flow rate change. The second option is the slowest but does not involve any change in the flow rates of streams. The third option appears preferable as it has an intermediate response time and requires only a minimal flow rate change.

  13. Control of advanced reactor-coupled heat exchanger system: Incorporation of reactor dynamics in system response to load disturbances

    International Nuclear Information System (INIS)

    Skavdahi, Isaac; Utgikar, Vivek; Christensen, Richard; Chen, Ming Hui; Sun, Xiao Dong; Sabharwall, Piyush

    2016-01-01

    Alternative control schemes for an Advanced High Temperature Reactor system consisting of a reactor, an intermediate heat exchanger, and a secondary heat exchanger (SHX) are presented in this paper. One scheme is designed to control the cold outlet temperature of the SHX (T_c_o) and the hot outlet temperature of the intermediate heat exchanger (Th_o_2) by manipulating the hot-side flow rates of the heat exchangers (F_h/F_h_2) responding to the flow rate and temperature disturbances. The flow rate disturbances typically require a larger manipulation of the flow rates than temperature disturbances. An alternate strategy examines the control of the cold outlet temperature of the SHX (T_c_o) only, since this temperature provides the driving force for energy production in the power conversion unit or the process application. The control can be achieved by three options: (1) flow rate manipulation; (2) reactor power manipulation; or (3) a combination of the two. The first option has a quicker response but requires a large flow rate change. The second option is the slowest but does not involve any change in the flow rates of streams. The third option appears preferable as it has an intermediate response time and requires only a minimal flow rate change

  14. Improvement of an automated protein crystal exchange system PAM for high-throughput data collection

    International Nuclear Information System (INIS)

    Hiraki, Masahiko; Yamada, Yusuke; Chavas, Leonard M. G.; Wakatsuki, Soichi; Matsugaki, Naohiro

    2013-01-01

    A special liquid-nitrogen Dewar with double capacity for the sample-exchange robot has been created at AR-NE3A at the Photon Factory, allowing continuous fully automated data collection. In this work, this new system is described and the stability of its calibration is discussed. Photon Factory Automated Mounting system (PAM) protein crystal exchange systems are available at the following Photon Factory macromolecular beamlines: BL-1A, BL-5A, BL-17A, AR-NW12A and AR-NE3A. The beamline AR-NE3A has been constructed for high-throughput macromolecular crystallography and is dedicated to structure-based drug design. The PAM liquid-nitrogen Dewar can store a maximum of three SSRL cassettes. Therefore, users have to interrupt their experiments and replace the cassettes when using four or more of them during their beam time. As a result of investigation, four or more cassettes were used in AR-NE3A alone. For continuous automated data collection, the size of the liquid-nitrogen Dewar for the AR-NE3A PAM was increased, doubling the capacity. In order to check the calibration with the new Dewar and the cassette stand, calibration experiments were repeatedly performed. Compared with the current system, the parameters of the novel system are shown to be stable

  15. Improvement of an automated protein crystal exchange system PAM for high-throughput data collection

    Energy Technology Data Exchange (ETDEWEB)

    Hiraki, Masahiko, E-mail: masahiko.hiraki@kek.jp; Yamada, Yusuke; Chavas, Leonard M. G. [High Energy Accelerator Research Organization, 1-1 Oho, Tsukuba, Ibaraki 305-0801 (Japan); Wakatsuki, Soichi [High Energy Accelerator Research Organization, 1-1 Oho, Tsukuba, Ibaraki 305-0801 (Japan); SLAC National Accelerator Laboratory, 2575 Sand Hill Road, MS 69, Menlo Park, CA 94025-7015 (United States); Stanford University, Beckman Center B105, Stanford, CA 94305-5126 (United States); Matsugaki, Naohiro [High Energy Accelerator Research Organization, 1-1 Oho, Tsukuba, Ibaraki 305-0801 (Japan)

    2013-11-01

    A special liquid-nitrogen Dewar with double capacity for the sample-exchange robot has been created at AR-NE3A at the Photon Factory, allowing continuous fully automated data collection. In this work, this new system is described and the stability of its calibration is discussed. Photon Factory Automated Mounting system (PAM) protein crystal exchange systems are available at the following Photon Factory macromolecular beamlines: BL-1A, BL-5A, BL-17A, AR-NW12A and AR-NE3A. The beamline AR-NE3A has been constructed for high-throughput macromolecular crystallography and is dedicated to structure-based drug design. The PAM liquid-nitrogen Dewar can store a maximum of three SSRL cassettes. Therefore, users have to interrupt their experiments and replace the cassettes when using four or more of them during their beam time. As a result of investigation, four or more cassettes were used in AR-NE3A alone. For continuous automated data collection, the size of the liquid-nitrogen Dewar for the AR-NE3A PAM was increased, doubling the capacity. In order to check the calibration with the new Dewar and the cassette stand, calibration experiments were repeatedly performed. Compared with the current system, the parameters of the novel system are shown to be stable.

  16. The Exchange Data Communication System based on Centralized Database for the Meat Industry

    Science.gov (United States)

    Kobayashi, Yuichi; Taniguchi, Yoji; Terada, Shuji; Komoda, Norihisa

    We propose applying the EDI system that is based on centralized database and supports conversion of code data to the meat industry. This system makes it possible to share exchange data on beef between enterprises from producers to retailers by using Web EDI technology. In order to efficiently convert code direct conversion of a sender's code to a receiver's code using a code map is used. This system that mounted this function has been implemented in September 2004. Twelve enterprises including retailers, and processing traders, and wholesalers were using the system as of June 2005. In this system, the number of code maps relevant to the introductory cost of the code conversion function was lower than the theoretical value and were close to the case that a standard code is mediated.

  17. Study of heat exchange in cooling systems of heat-stressed structures

    Science.gov (United States)

    Vikulin, A. V.; Yaroslavtsev, N. L.; Zemlyanaya, V. A.

    2017-01-01

    Increasing working parameters of the cycle of gas-turbine engines, complicating design of gas-turbine plants, as well as growing aerodynamic, thermal, static, and dynamic loads, necessitate the development of promising cooling systems for heat-stressed structures. This work is devoted to an experimental study of heat exchange in ducts equipped with systems of inclined and cross walls (fins). It has been found that an increase in the Reynolds number Re from 3000 to 20000 leads to a decrease in the heat exchange, which is characterized by the relative Nusselt number overline{Nu}, by 19-30% at the angle of inclination of the walls φ = 0, 40°, 50°, and 90° if the length of the walls x w is comparable to the spacing b s and by 12-15% at φ = 30° and 90° if x w ≫ b s. If cross walls are used in cooling ducts, the length of the walls x w plays the governing role; an increase in this characteristic from 1.22 × 10-3 to 3.14 × 10-3 m leads to an increase in the intensity of heat exchange by 30-40% and to a decrease in the capacity of the entire system of the walls. It has been shown that, on surfaces with wavy fins, the intensity of heat exchange is closest to that determined in the models under study. For example, values of the Colborne criterion StPr2/3 for ducts equipped with wavy fins and for the models under study differ only slightly (by 2-20% depending on the value of the angle φ). However, the difference for surfaces with short plate fins and ducts equipped with inclined walls is high (30-40%). This is due to the design features of these surfaces and to the severe effect of the inlet portion on heat exchange, since the surfaces are characterized by a higher ratio of the duct length to the hydraulic diameter L/d h at small fin thicknesses ((0.1-0.15) × 10-3 m). The experimental results can be used in developing designs of nozzle and rotor blades of high-temperature gas turbines in gas-turbine engines and plants.

  18. Horizontal Heat Exchanger Design and Analysis for Passive Heat Removal Systems

    Energy Technology Data Exchange (ETDEWEB)

    Vierow, Karen

    2005-08-29

    This report describes a three-year project to investigate the major factors of horizontal heat exchanger performance in passive containment heat removal from a light water reactor following a design basis accident LOCA (Loss of Coolant Accident). The heat exchanger studied in this work may be used in advanced and innovative reactors, in which passive heat removal systems are adopted to improve safety and reliability The application of horizontal tube-bundle condensers to passive containment heat removal is new. In order to show the feasibility of horizontal heat exchangers for passive containment cooling, the following aspects were investigated: 1. the condensation heat transfer characteristics when the incoming fluid contains noncondensable gases 2. the effectiveness of condensate draining in the horizontal orientation 3. the conditions that may lead to unstable condenser operation or highly degraded performance 4. multi-tube behavior with the associated secondary-side effects This project consisted of two experimental investigations and analytical model development for incorporation into industry safety codes such as TRAC and RELAP. A physical understanding of the flow and heat transfer phenomena was obtained and reflected in the analysis models. Two gradute students (one funded by the program) and seven undergraduate students obtained research experience as a part of this program.

  19. Systematic generation of buffer systems for pH gradient ion exchange chromatography and their application.

    Science.gov (United States)

    Kröner, Frieder; Hubbuch, Jürgen

    2013-04-12

    pH gradient protein separations are widely used techniques in the field of protein analytics, of which isoelectric focusing is the most well known application. The chromatographic variant, based on the formation of pH gradients in ion exchange columns is only rarely applied due to the difficulties to form controllable, linear pH gradients over a broad pH range. This work describes a method for the systematic generation of buffer compositions with linear titration curves, resulting in well controllable pH gradients. To generate buffer compositions with linear titration curves an in silico method was successfully developed. With this tool, buffer compositions for pH gradient ion exchange chromatography with pH ranges spanning up to 7.5 pH units were established and successfully validated. Subsequently, the buffer systems were used to characterize the elution behavior of 22 different model proteins in cation and anion exchange pH gradient chromatography. The results of both chromatographic modes as well as isoelectric focusing were compared to describe differences in between the methods. Copyright © 2013 Elsevier B.V. All rights reserved.

  20. Characterization of Na+-linked and Na+-independent Cl-/HCO3- exchange systems in Chinese hamster lung fibroblasts

    International Nuclear Information System (INIS)

    Cassel, D.; Scharf, O.; Rotman, M.; Cragoe, E.J. Jr.; Katz, M.

    1988-01-01

    The PS120 variant of Chinese hamster lung fibroblasts which lacks Na + /H + exchange activity was used to investigate bicarbonate transport systems and their role in intracellular pH (pH/sub i/) regulation. When pH/sub i/ was decreased by acid load, bicarbonate caused pH/sub i/ increase and stimulated 36 Cl - efflux from the cells, both in a Na + -dependent manner. These results together with previous findings that bicarbonate stimulates 22 Na + uptake in PS120 cells demonstrate the presence of a Na + -linked Cl - /HCO 3 - exchange system. In cells with normal initial pH/sub i/, bicarbonate caused Na + -independent pH/sub i/ increase in Cl - -free solutions and stimulated Na + -independent 36 Cl - efflux, indicating that a Na + -independent Cl - /HCO 3 - exchanger is also present in the cell. Na + -linked and Na + -independent Cl - /HCO 3- exchange is apparently mediated by two distinct systems, since a [(tetrahydrofluorene-7-yl)oxy]acetic acid derivative selectively inhibits the Na + -independent exchanger. An additional distinctive features is a 10-fold lower affinity for chloride of the Na + -linked exchanger. The Na + -linked and Na + -independent Cl - /HCO 3 - exchange systems are likely to protect the cell from acid and alkaline load, respectively

  1. Experimental evaluation of improved dual temperature hydrogen isotopic exchange reaction system

    International Nuclear Information System (INIS)

    Asakura, Yamato; Uchida, Shunsuke

    1984-01-01

    A proposed dual temperature hydrogen isotopic exchange reaction system between water and hydrogen gas is evaluated experimentally. The proposed system is composed of low temperature co-current reactors for reaction between water mists and hydrogen gas and high temperature co-current reactors for reaction between water vapor and hydrogen gas. Thus, operation is possible under atmospheric pressure with high reaction efficiency. Using the pilot test system which is composed of ten low temperature (30 0 C) reaction units and ten high temperature (200 0 C) reaction units, an experimental separation of deuterium from light water is carried out. The enrichment factor under steady state conditions, its dependency on operating time, and the reaction period necessary to obtain the steady state enrichment factor are determined experimentally and compared with calculations. It is shown that separation ability in a multistage reaction system can be estimated by numerical calculation using actual reaction efficiency in a unit reactor. (author)

  2. A Novel RFID Sensing System Using Enhanced Surface Wave Technology for Battery Exchange Stations

    Directory of Open Access Journals (Sweden)

    Yeong-Lin Lai

    2014-01-01

    Full Text Available This paper presents a novel radio-frequency identification (RFID sensing system using enhanced surface wave technology for battery exchange stations (BESs of electric motorcycles. Ultrahigh-frequency (UHF RFID technology is utilized to automatically track and manage battery and user information without manual operation. The system includes readers, enhanced surface wave leaky cable antennas (ESWLCAs, coupling cable lines (CCLs, and small radiation patches (SRPs. The RFID sensing system overcomes the electromagnetic interference in the metallic environment of a BES cabinet. The developed RFID sensing system can effectively increase the efficiency of BES operation and promote the development of electric vehicles which solve the problem of air pollution as well as protect the environment of the Earth.

  3. NILDE, Network Inter Library Document Exchange: An Italian Document Delivery System

    Science.gov (United States)

    Brunetti, F.; Gasperini, A.; Mangiaracina, S.

    2007-10-01

    This poster presents NILDE, a document delivery system supporting the exchange of documents via the internet. The system has been set up by the Central Library of the National Research Council of Bologna (Italy) in order to make use of new internet technology, to promote cooperation between Italian university libraries and research libraries, and to achieve quick response times in satisfying DD requests. The Arcetri Astrophysical Observatory Library was the first astronomical library to join the NILDE project from its earliest days in 2002. Many were the reasons for this choice: automation of the DD processes, security and reliability of the network, creation of usage statistics and reports, reduction of DD System management costs and so on. This work describes the benefits of NILDE and discusses the role of an organized document delivery system as an important tool to cope with the difficult constraints of the publishing market.

  4. Hybrid systems with lead-acid battery and proton-exchange membrane fuel cell

    Science.gov (United States)

    Jossen, Andreas; Garche, Juergen; Doering, Harry; Goetz, Markus; Knaupp, Werner; Joerissen, Ludwig

    Hybrid systems, based on a lead-acid battery and a proton-exchange membrane fuel cell (PEMFC) give the possibility to combine the advantages of both technologies. The benefits for different applications are discussed and the practical realisation of such systems is shown. Furthermore a numerical model for such a hybrid system is described and results are shown and discussed. The results show that the combination of lead-acid batteries and PEMFC shows advantages in case of applications with high peak power requirements (i.e. electric scooter) and applications where the fuel cell is used as auxiliary power supply to recharge the battery. The high efficiency of fuel cells at partial load operation results in a good fuel economy for recharging of lead-acid batteries with a fuel cell system.

  5. A New Hybrid Proton-Exchange-Membrane Fuel Cells-Battery Power System with Efficiencies Considered

    Science.gov (United States)

    Chao, Chung-Hsing; Shieh, Jenn-Jong

    Hybrid systems, based on lead-acid or lithium-ion batteries and proton-exchange-membrane fuel cells (PEMFCs), give the possibility of combining the benefit of both technologies. The merits of high energy density and power density for different applications are discussed in this paper in recognition of the practical realization of such hybrid power systems. Furthermore, experimental data for such a hybrid system is described and the results are shown and discussed. The results show that the combination of lead-acid batteries or lithium-ion batteries and PEMFCs shows advantages in cases of applications with high peak power requirements, such as electric scooters and applications where the fuel cell (FC) is used as an auxiliary power-supply to recharge the battery. The high efficiency of FCs operating with a partial load results in a good fuel economy for the purpose of recharging batteries within a FC system.

  6. Real-time data exchange system in CSRe and RIBBLL II

    International Nuclear Information System (INIS)

    Liu Wufeng; Xu Yang; Li Guohua; Guo Yuhui; Chinese Academy of Sciences, Beijing; Qiao Weimin; Jing Lan; Wang Yongping; Gou Shizhe

    2008-01-01

    The design of real-time data exchange system in HIRFL-CSR's CSRe and RIBLL II has been introduced, including it's design of software and hardware. This system realizes controlling power devices at the same time. In system, data is from web browser to center Oracle database. And then, it arrives at sqlite database in ARM module by way of front-server's Oracle database by COM module. Finally, ARM module transmits data to DSP module's memory to control power devices when event is same. At the same time, ADC can acquire device's current value or voltage value which is saved in center Oracle data-base. Practice shows that this system has the character of high reliability and stability. (authors)

  7. Determination of Minimum Data Set (MSD) in Echocardiography Reporting System to Exchange with Iran's Electronic Health Record (EHR) System.

    Science.gov (United States)

    Mahmoudvand, Zahra; Kamkar, Mehran; Shahmoradi, Leila; Nejad, Ahmadreza Farzaneh

    2016-04-01

    Determination of minimum data set (MDS) in echocardiography reports is necessary for documentation and putting information in a standard way, and leads to the enhancement of electrocardiographic studies through having access to precise and perfect reports and also to the development of a standard database for electrocardiographic reports. to determine the minimum data set of echocardiography reporting system to exchange with Iran's electronic health record (EHR) system. First, a list of minimum data set was prepared after reviewing texts and studying cardiac patients' records. Then, to determine the content validity of the prepared MDS, the expert views of 10 cardiologists and 10 health information management (HIM) specialists were obtained; to estimate the reliability of the set, test-retest method was employed. Finally, the data were analyzed using SPSS software. The highest degree of consensus was found for the following MDSs: patient's name and family name (5), accepting doctor's name and family name, familial death records due to cardiac disorders, the image identification code, mitral valve, aortic valve, tricuspid valve, pulmonary valve, left ventricle, hole, atrium valve, Doppler examination of ventricular and atrial movement models and diagnoses with an average of. To prepare a model of echocardiography reporting system to exchange with EHR system, creation a standard data set is the vital point. Therefore, based on the research findings, the minimum reporting system data to exchange with Iran's electronic health record system include information on entity, management, medical record, carried-out acts, and the main content of the echocardiography report, which the planners of reporting system should consider.

  8. Technology and Policy Challenges in the Adoption and Operation of Health Information Exchange Systems.

    Science.gov (United States)

    Ji, Hyerim; Yoo, Sooyoung; Heo, Eun-Young; Hwang, Hee; Kim, Jeong-Whun

    2017-10-01

    This study aimed to identify problems and issues that arise with the implementation of online health information exchange (HIE) systems in a medical environment and to identify solutions to facilitate the successful operation of future HIE systems in primary care clinics and hospitals. In this study, the issues that arose during the establishment and operation of an HIE system in a hospital were identified so that they could be addressed to enable the successful establishment and operation of a standard-based HIE system. After the issues were identified, they were reviewed and categorized by a group of experts that included medical information system experts, doctors, medical information standard experts, and HIE researchers. Then, solutions for the identified problems were derived based on the system development, operation, and improvement carried out during this work. Twenty-one issues were identified during the implementation and operation of an online HIE system. These issues were then divided into four categories: system architecture and standards, documents and data items, consent of HIE, and usability. We offer technical and policy recommendations for various stakeholders based on the experiences of operating and improving the online HIE system in the medical field. The issues and solutions identified in this study regarding the implementation and operate of an online HIE system can provide valuable insight for planners to enable them to successfully design and operate such systems at a national level in the future. In addition, policy support from governments is needed.

  9. Observability and Estimation of Distributed Space Systems via Local Information-Exchange Networks

    Science.gov (United States)

    Fathpour, Nanaz; Hadaegh, Fred Y.; Mesbahi, Mehran; Rahmani, Amirreza

    2011-01-01

    Spacecraft formation flying involves the coordination of states among multiple spacecraft through relative sensing, inter-spacecraft communication, and control. Most existing formation-flying estimation algorithms can only be supported via highly centralized, all-to-all, static relative sensing. New algorithms are proposed that are scalable, modular, and robust to variations in the topology and link characteristics of the formation exchange network. These distributed algorithms rely on a local information exchange network, relaxing the assumptions on existing algorithms. Distributed space systems rely on a signal transmission network among multiple spacecraft for their operation. Control and coordination among multiple spacecraft in a formation is facilitated via a network of relative sensing and interspacecraft communications. Guidance, navigation, and control rely on the sensing network. This network becomes more complex the more spacecraft are added, or as mission requirements become more complex. The observability of a formation state was observed by a set of local observations from a particular node in the formation. Formation observability can be parameterized in terms of the matrices appearing in the formation dynamics and observation matrices. An agreement protocol was used as a mechanism for observing formation states from local measurements. An agreement protocol is essentially an unforced dynamic system whose trajectory is governed by the interconnection geometry and initial condition of each node, with a goal of reaching a common value of interest. The observability of the interconnected system depends on the geometry of the network, as well as the position of the observer relative to the topology. For the first time, critical GN&C (guidance, navigation, and control estimation) subsystems are synthesized by bringing the contribution of the spacecraft information-exchange network to the forefront of algorithmic analysis and design. The result is a

  10. Effects on Communicative Requesting and Speech Development of the Picture Exchange Communication System in Children with Characteristics of Autism

    Science.gov (United States)

    Ganz, Jennifer B.; Simpson, Richard L.

    2004-01-01

    Few studies on augmentative and alternative communication (AAC) systems have addressed the potential for such systems to impact word utterances in children with autism spectrum disorders (ASD). The Picture Exchange Communication System (PECS) is an AAC system designed specifically to minimize difficulties with communication skills experienced by…

  11. Evolution of the Tropical Cyclone Integrated Data Exchange And Analysis System (TC-IDEAS)

    Science.gov (United States)

    Turk, J.; Chao, Y.; Haddad, Z.; Hristova-Veleva, S.; Knosp, B.; Lambrigtsen, B.; Li, P.; Licata, S.; Poulsen, W.; Su, H.; hide

    2010-01-01

    The Tropical Cyclone Integrated Data Exchange and Analysis System (TC-IDEAS) is being jointly developed by the Jet Propulsion Laboratory (JPL) and the Marshall Space Flight Center (MSFC) as part of NASA's Hurricane Science Research Program. The long-term goal is to create a comprehensive tropical cyclone database of satellite and airborne observations, in-situ measurements and model simulations containing parameters that pertain to the thermodynamic and microphysical structure of the storms; the air-sea interaction processes; and the large-scale environment.

  12. Borehole heat exchangers: Longterm operational characteristics of a decentral geothermal heating system

    International Nuclear Information System (INIS)

    Rybach, L.; Eugster, W.J.; Hopkirk, R.J.; Kaelin, B.

    1992-01-01

    The heat pump-coupled borehole heat exchanger (BHE) is an efficient and small geothermal energy system for supplying heat typically to a single dwelling house. The long-term performance characteristics have been investigated by computer simulations. The numerical models were validated by measurements at instrumented BHE facilities. The results show the development of a new thermal equilibrium state after the first few years of BHE operation. The thermal influence is limited to the first few meters of the ground surrounding the BHE. The BHE could be scaled up in order to be installed in deep 'failed' holes (e.g. dry geothermal or hydrocarbon exploration holes)

  13. User experiences with different regional health information exchange systems in Finland.

    Science.gov (United States)

    Hyppönen, Hannele; Reponen, Jarmo; Lääveri, Tinja; Kaipio, Johanna

    2014-01-01

    The interest in cross-organizational Health Information Exchange (HIE) is increasing at regional, national and cross-European levels. The purpose of our study was to compare user experiences (usability) of different regional health information exchange system (RHIE) types as well as the factors related to the experienced level of success of different RHIE system types. A web-based questionnaire was sent to 95% of Finnish physicians aged between 25 and 65 years of age. RHIE systems were mainly available in the public sector and only in certain regions. Those 1693 physicians were selected from the 3929 respondents of the original study, who met these criteria. The preferred means (paper/fax vs. electronic) of cross-organizational HIE, and replies to the 11 questions measuring RHIE success were used as the main dependent variables. Two thirds (73%) of the primary care physicians and one third (33%) of the specialized care physicians replied using an electronic RHIE system rather than paper or fax as a primary means of cross-organizational HIE. Respondents from regions where a regional virtual EHR (type 3) RHIE system was employed had used electronic means rather than paper HIE to a larger extend compared to their colleagues in regions where a master patient index-type (type 1) or web distribution model (type 2) RHIE system was used. Users of three local EHR systems preferred electronic HIE to paper to a larger extend than users of other EHR systems. Experiences with an integrated RHIE system (type 3) were more positive than those with other types or RHIE systems. The study revealed User preferences for the integrated virtual RHIE-system (type 3) over the master index model (type 1) or web distribution model (type 2). Success of individual HIE tasks of writing, sending and reading were impacted by the way these functionalities were realized in the EHR systems. To meet the expectations of increased efficiency, continuity, safety and quality of care, designers of HIE

  14. Application of expert systems to heat exchanger control at the 100-megawatt high-flux isotope reactor

    International Nuclear Information System (INIS)

    Clapp, N.E. Jr.; Clark, F.H.; Mullens, J.A.; Otaduy, P.J.; Wehe, D.K.

    1985-01-01

    The High-Flux Isotope Reactor (HFIR) is a 100-MW pressurized water reactor at the Oak Ridge National Laboratory. It is used to produce isotopes and as a source of high neutron flux for research. Three heat exchangers are used to remove heat from the reactor to the cooling towers. A fourth heat exchanger is available as a spare in case one of the operating heat exchangers malfunctions. It is desirable to maintain the reactor at full power while replacing the failed heat exchanger with the spare. The existing procedures used by the operators form the initial knowledge base for design of an expert system to perform the switchover. To verify performance of the expert system, a dynamic simulation of the system was developed in the MACLISP programming language. 2 refs., 3 figs

  15. Quantifying the Pathway and Predicting Spontaneous Emulsification during Material Exchange in a Two Phase Liquid System.

    Science.gov (United States)

    Spooner, Stephen; Rahnama, Alireza; Warnett, Jason M; Williams, Mark A; Li, Zushu; Sridhar, Seetharaman

    2017-10-30

    Kinetic restriction of a thermodynamically favourable equilibrium is a common theme in materials processing. The interfacial instability in systems where rate of material exchange is far greater than the mass transfer through respective bulk phases is of specific interest when tracking the transient interfacial area, a parameter integral to short processing times for productivity streamlining in all manufacturing where interfacial reaction occurs. This is even more pertinent in high-temperature systems for energy and cost savings. Here the quantified physical pathway of interfacial area change due to material exchange in liquid metal-molten oxide systems is presented. In addition the predicted growth regime and emulsification behaviour in relation to interfacial tension as modelled using phase-field methodology is shown. The observed in-situ emulsification behaviour links quantitatively the geometry of perturbations as a validation method for the development of simulating the phenomena. Thus a method is presented to both predict and engineer the formation of micro emulsions to a desired specification.

  16. Lab-scale experiment of a closed thermochemical heat storage system including honeycomb heat exchanger

    International Nuclear Information System (INIS)

    Fopah-Lele, Armand; Rohde, Christian; Neumann, Karsten; Tietjen, Theo; Rönnebeck, Thomas; N'Tsoukpoe, Kokouvi Edem; Osterland, Thomas; Opel, Oliver

    2016-01-01

    A lab-scale thermochemical heat storage reactor was developed in the European project “thermal battery” to obtain information on the characteristics of a closed heat storage system, based on thermochemical reactions. The present type of storage is capable of re-using waste heat from cogeneration system to produce useful heat for space heating. The storage material used was SrBr 2 ·6H 2 O. Due to agglomeration or gel-like problems, a structural element was introduced to enhance vapour and heat transfer. Honeycomb heat exchanger was designed and tested. 13 dehydration-hydration cycles were studied under low-temperature conditions (material temperatures < 100 °C) for storage. Discharging was realized at water vapour pressure of about 42 mbar. Temperature evolution inside the reactor at different times and positions, chemical conversion, thermal power and overall efficiency were analysed for the selected cycles. Experimental system thermal capacity and efficiency of 65 kWh and 0.77 are respectively obtained with about 1 kg of SrBr 2 ·6H 2 O. Heat transfer fluid recovers heat at a short span of about 43 °C with an average of 22 °C during about 4 h, acceptable temperature for the human comfort (20 °C on day and 16 °C at night). System performances were obtained for a salt bed energy density of 213 kWh·m 3 . The overall heat transfer coefficient of the honeycomb heat exchanger has an average value of 147 W m −2  K −1 . Though promising results have been obtained, ameliorations need to be made, in order to make the closed thermochemical heat storage system competitive for space heating. - Highlights: • Lab-scale thermochemical heat storage is designed, constructed and tested. • The use of honeycomb heat exchanger as a heat and vapour process enhancement. • Closed system (1 kg SrBr 2 ·6H 2 O) able to give back 3/4 of initial thermal waste energy. • System storage capacity and thermal efficiency are respectively 65 kWh and 0.77.

  17. Performance variations of river water source heat pump system according to heat exchanger capacity variations

    International Nuclear Information System (INIS)

    Park, Seong Ryong; Baik, Young Jin; Lee, Young Soo; Kim, Hee Hwan

    2003-01-01

    The utilization of unused energy is important because it can afford to offer a chance to increase energy efficiency of a heat pump system. One of the promising unused energy sources is river water. It can be used as a heat source in both heating and cooling effectively with its superior features as a secondary working fluids. In this study, the performance of a 5HP heat pump system using river water as a heat source is investigated by both experiment and simulation. According to system simulation results, performance improvement of condenser seems more effective than that of evaporator for better COPH. The serial connection is also preferred among several methods to improve plate type heat exchanger performance. The experimental results show that the hot water of 50∼60 .deg. C can be acquired from water heat source of 5∼9 .deg. C with COPH of 2.7∼3.5

  18. Site-specific cassette exchange systems in the Aedes aegypti mosquito and the Plutella xylostella moth.

    Directory of Open Access Journals (Sweden)

    Roya Elaine Haghighat-Khah

    Full Text Available Genetically engineered insects are being evaluated as potential tools to decrease the economic and public health burden of mosquitoes and agricultural pest insects. Here we describe a new tool for the reliable and targeted genome manipulation of pest insects for research and field release using recombinase mediated cassette exchange (RMCE mechanisms. We successfully demonstrated the established ΦC31-RMCE method in the yellow fever mosquito, Aedes aegypti, which is the first report of RMCE in mosquitoes. A new variant of this RMCE system, called iRMCE, combines the ΦC31-att integration system and Cre or FLP-mediated excision to remove extraneous sequences introduced as part of the site-specific integration process. Complete iRMCE was achieved in two important insect pests, Aedes aegypti and the diamondback moth, Plutella xylostella, demonstrating the transferability of the system across a wide phylogenetic range of insect pests.

  19. Development of volume-reduction system for ion exchange resin using inductively coupled plasma

    International Nuclear Information System (INIS)

    Fujisawa, Morio; Katagiri, Genichi

    2002-01-01

    The spent ion exchange resin generated as radioactive waste in water purifying system at nuclear power stations or related facilities of nuclear power has been stored in the site, and its volume has been increasing year by year. We had developed a full-scale system of IC plasma volume-reduction system for the spent resin, and have performed basic performance test using some samples imitating the spent resin. As the results, the imitation of the resin can be reduced in volume by more than 90% so that the processing performance in actual scale was proved to be effective. In addition, it was clarified that the residuum after volume-reduction process is easy to mix with cement, and solidity containing 30wt% residuum provides high strength of 68 MPa. Therefore, we evaluate the application of this process to stabilization of the disposal to be very effective. (author)

  20. A MODEL OF HETEROGENEOUS DISTRIBUTED SYSTEM FOR FOREIGN EXCHANGE PORTFOLIO ANALYSIS

    Directory of Open Access Journals (Sweden)

    Dragutin Kermek

    2006-06-01

    Full Text Available The paper investigates the design of heterogeneous distributed system for foreign exchange portfolio analysis. The proposed model includes few separated and dislocated but connected parts through distributed mechanisms. Making system distributed brings new perspectives to performance busting where software based load balancer gets very important role. Desired system should spread over multiple, heterogeneous platforms in order to fulfil open platform goal. Building such a model incorporates different patterns from GOF design patterns, business patterns, J2EE patterns, integration patterns, enterprise patterns, distributed design patterns to Web services patterns. The authors try to find as much as possible appropriate patterns for planned tasks in order to capture best modelling and programming practices.

  1. Site-Specific Cassette Exchange Systems in the Aedes aegypti Mosquito and the Plutella xylostella Moth

    Science.gov (United States)

    Haghighat-Khah, Roya Elaine; Scaife, Sarah; Martins, Sara; St John, Oliver; Matzen, Kelly Jean; Morrison, Neil; Alphey, Luke

    2015-01-01

    Genetically engineered insects are being evaluated as potential tools to decrease the economic and public health burden of mosquitoes and agricultural pest insects. Here we describe a new tool for the reliable and targeted genome manipulation of pest insects for research and field release using recombinase mediated cassette exchange (RMCE) mechanisms. We successfully demonstrated the established ΦC31-RMCE method in the yellow fever mosquito, Aedes aegypti, which is the first report of RMCE in mosquitoes. A new variant of this RMCE system, called iRMCE, combines the ΦC31-att integration system and Cre or FLP-mediated excision to remove extraneous sequences introduced as part of the site-specific integration process. Complete iRMCE was achieved in two important insect pests, Aedes aegypti and the diamondback moth, Plutella xylostella, demonstrating the transferability of the system across a wide phylogenetic range of insect pests. PMID:25830287

  2. Performance study of desiccant coated heat exchanger air conditioning system in winter

    International Nuclear Information System (INIS)

    Ge, T.S.; Dai, Y.J.; Wang, R.Z.

    2016-01-01

    Highlights: • Performance of desiccant coated heat exchanger AC system is predicted. • Effects of main operation parameters and climatic conditions are discussed. • Regeneration temperature of 30 °C is recommended under simulation condition. • Higher ambient humidity ratio results in increased humidity ratio of supply air. • Temperature of ambient air has neglectable effect on supply air. - Abstract: Conventional air source heat pump system faces several challenges when adopted in winter season. Solid desiccant air conditioning system can provide humidification and heating power simultaneously and can be driven by low grade thermal energy; it provides a good alternative for air source heat pump systems. However, conventional solid desiccant air conditioning system adopts desiccant wheel with high cost as core component, which hinders the development of such system. Recently, desiccant coated heat exchanger (DCHE) with low initial cost and high efficiency was developed and this paper aims to investigate performance of DCHE air conditioning system adopted in Shanghai winter season. Performance of the system is predicted by a developed mathematical model where supply air states, mass of humidification and coefficient of performance (COP) are adopted as performance indices to evaluate the feasibility and energy utilization ratio of the system. Effects of regeneration water temperature on system performance are analyzed. It is found that under the simulation condition, relatively low regeneration temperature (such as 20 °C) cannot meet the designed standard and relatively high regeneration temperature (such as 40 °C) provides too much extra heating power, thus moderate regeneration temperature around 30 °C is recommended. Meanwhile, switch time is a crucial operation parameter for the system to obtain satisfied supply air, switch time from 40 s to 80 s and from 70 s to 240 s are recommended for transient and average supply air states, respectively. Both

  3. Isotope effects in ion-exchange equilibria in aqueous and mixed solvent systems

    International Nuclear Information System (INIS)

    Gupta, A.R.

    1979-01-01

    Isotope effects in ion-exchange equilibria in aqueous and mixed solvents are analyzed in terms of the general features of ion-exchange equilibria and of isotope effects in chemical equilibria. The special role of solvent fractionation effects in ion-exchange equilibria in mixed solvents is pointed out. The various situations arising in isotope fractionation in ion exchange in mixed solvents due to solvent fractionation effects are theoretically discussed. The experimental data on lithium isotope effects in ion-exchange equilibria in mixed solvents are shown to conform to the above situations. The limitations of ion-exchange equilibria in mixed solvents for isotope fractionation are pointed out. 3 tables

  4. Acidity field of soils as ion-exchange systems and the diagnostics of genetic soil horizons

    Science.gov (United States)

    Kokotov, Yu. A.; Sukhacheva, E. Yu.; Aparin, B. F.

    2014-12-01

    For the comprehensive description of the acidity of a two-phase ion-exchange system, we should analyze two curves of the ionite titration by a strong base in water and salt solutions and find the quantitative relationships between the corresponding pH characteristics. An idea of the three-dimensional field of acidity of ion-exchange systems (the phase space of the soil acidity characteristics) and its three two-dimensional projections is suggested. For soils, three interrelated characteristics—the pH values of the salt and water extracts and the degree of base saturation—can serve as spatial coordinates for the acidity field. Representation of factual data in this field makes it possible to compare and analyze the acidity characteristics of different soils and soil horizons and to determine their specific features. Differentiation of the field into separate volumes allows one to present the data in a discrete form. We have studied the distribution patterns of the groups of soil horizons from Leningrad oblast and other regions of northwestern Russia in the acidity field. The studied samples are grouped in different partially overlapping areas of the projections of the acidity field. The results of this grouping attest to the correctness of the modern classification of Russian soils. A notion of the characteristic soil area in the acidity field is suggested; it can be applied to all the soils with a leaching soil water regime.

  5. LACK OF AGREEMENT BETWEEN GAS EXCHANGE VARIABLES MEASURED BY TWO METABOLIC SYSTEMS

    Directory of Open Access Journals (Sweden)

    DjordjeG. Jakovljevic

    2008-03-01

    Full Text Available The purpose of this study was to assess the agreement and consistency between gas exchange variables measured by two online metabolic systems during an incremental exercise test. After obtaining local ethics approval and informed consent, 15 healthy subjects performed an incremental exercise test to volitional fatigue using the Bruce protocol. The Innocor (Innovision, Denmark and CardiO2 (Medical Graphics, USA systems were placed in series, with the Innocor mouthpiece attached to the pneumotach of the CardiO2. Metabolic data were analysed during the last 30 seconds of each stage and at peak exercise. There were non- significant differences (p > 0.05 between the two systems in estimation of oxygen consumption (VO2 and in minute ventilation (VE. Mean Cronbach's alpha for VO2 and VE were 0.88 and 0.92. The Bland-Altman analysis revealed that limits of agreement were -0.52 to 0.55 l.min-1 for VO2, and -8.74 to 10.66 l.min-1 for VE. Carbon dioxide production (VCO2 and consequently respiratory exchange ratio (RER measured by the Innocor were significantly lower (p < 0.05 through all stages. The CardiO2 measured fraction of expired carbon dioxide (FeCO2 significantly higher (p < 0.05. The limits of agreement for VO2 and VE are wide and unacceptable in cardio-pulmonary exercise testing. The Innocor reported VCO2 systematically lower. Therefore the Innocor and CardiO2 metabolic systems cannot be used interchangeably without affecting the diagnosis of an individual patient. Results from the present study support previous suggestion that considerable care is needed when comparing metabolic data obtained from different automated metabolic systems.

  6. A study on the formation of fouling in a heat exchanging system for Han-river water as cooling water

    International Nuclear Information System (INIS)

    Sung, Sun Kyung; Suh, Sang Ho; Rho, Hyung Woon; Cho, Young Il

    2003-01-01

    Scale is formed when hard water is heated or cooled in heat transfer equipments such as heat exchangers, condensers, evaporators, cooling towers, boilers, and pipe walls. When scale deposits in a heat exchanger surface, it is traditionally called fouling. The objective of the present study is to investigate the formation of fouling in a heat exchanging system. A lab-scale heat exchanging system is built-up to observe and measure the formation of fouling experimentally. Water analyses are conducted to obtain the properties of Han river water. In the present study a microscopic observation is conducted to visualize the process of scale formation. Hardness of Han-river water is higher than that of tap water in Seoul

  7. Influence of additional heat exchanger block on directional solidification system for growing multi-crystalline silicon ingot - A simulation investigation

    Science.gov (United States)

    Nagarajan, S. G.; Srinivasan, M.; Aravinth, K.; Ramasamy, P.

    2018-04-01

    Transient simulation has been carried out for analyzing the heat transfer properties of Directional Solidification (DS) furnace. The simulation results revealed that the additional heat exchanger block under the bottom insulation on the DS furnace has enhanced the control of solidification of the silicon melt. Controlled Heat extraction rate during the solidification of silicon melt is requisite for growing good quality ingots which has been achieved by the additional heat exchanger block. As an additional heat exchanger block, the water circulating plate has been placed under the bottom insulation. The heat flux analysis of DS system and the temperature distribution studies of grown ingot confirm that the established additional heat exchanger block on the DS system gives additional benefit to the mc-Si ingot.

  8. Characterization and control of the microbial community affiliated with copper or aluminum heat exchangers of HVAC systems.

    Science.gov (United States)

    Schmidt, Michael G; Attaway, Hubert H; Terzieva, Silva; Marshall, Anna; Steed, Lisa L; Salzberg, Deborah; Hamoodi, Hameed A; Khan, Jamil A; Feigley, Charles E; Michels, Harold T

    2012-08-01

    Microbial growth in heating ventilation and air-conditioning (HVAC) systems with the subsequent contamination of indoor air is of increasing concern. Microbes and the subsequent biofilms grow easily within heat exchangers. A comparative study where heat exchangers fabricated from antimicrobial copper were evaluated for their ability to limit microbial growth was conducted using a full-scale HVAC system under conditions of normal flow rates using single-pass outside air. Resident bacterial and fungal populations were quantitatively assessed by removing triplicate sets of coupons from each exchanger commencing the fourth week after their installation for the next 30 weeks. The intrinsic biofilm associated with each coupon was extracted and characterized using selective and differential media. The predominant organisms isolated from aluminum exchangers were species of Methylobacterium of which at least three colony morphologies and 11 distinct PFGE patterns we found; of the few bacteria isolated from the copper exchangers, the majority were species of Bacillus. The concentrations and type of bacteria recovered from the control, aluminum, exchangers were found to be dependent on the type of plating media used and were 11,411-47,257 CFU cm(-2) per coupon surface. The concentration of fungi was found to average 378 CFU cm(-2). Significantly lower concentrations of bacteria, 3 CFU cm(-2), and fungi, 1 CFU cm(-2), were recovered from copper exchangers regardless of the plating media used. Commonly used aluminum heat exchangers developed stable, mixed, bacterial/fungal biofilms in excess of 47,000 organisms per cm(2) within 4 weeks of operation, whereas the antimicrobial properties of metallic copper were able to limit the microbial load affiliated with the copper heat exchangers to levels 99.97 % lower during the same time period.

  9. Derivation of a pion-rho exchange three-body force and application to the trinucleon system

    International Nuclear Information System (INIS)

    Robillota, M.R.; Isidro Filho, M.P.

    1982-12-01

    The pion-rho exchange three-body force is derived by means of Lagrangians which are approximately invariant under chiral and gauge transformations. The leading contribution to the potential arises from a seagull diagram, which corresponds to forces that are dominantly repulsive and comparable to those due to the exchange of two pions. The qualitative features of the results are analysed by means of plots of the energy of the trinucleon system. (Author) [pt

  10. Derivation of a pion-RHO exchange three-body force and application to the trinucleon system

    International Nuclear Information System (INIS)

    Robilotta, M.R.; Isidro Filho, M.P.

    1984-01-01

    The pion-rho exchange three-body force is derived by means of lagrangians which are approximately invariant under chiral and gauge transformations. The leading contribution to the potential arises from a seagull diagram, which corresponds to forces that are dominantly repulsive and comparable to those due to the exchange of two pions. The qualitative features of our results are analysed by means of plots of the energy of the trinucleon system. (orig.)

  11. Towards a multi-agent system for regulated information exchange in crime investigations

    NARCIS (Netherlands)

    Dijkstra, Pieter; Prakken, H.; Vey Mestdagh, C.N.J. de

    2005-01-01

    This paper outlines a multi-agent architecture for regulated information exchange of crime investigation data between police forces. Interactions between police officers about information exchange are analysed as negotiation dialogues with embedded persuasion dialogues. An architecture is then

  12. Thermochemical study of deuterium exchange reactions in water-alcohol and alcohol-alcohol systems

    International Nuclear Information System (INIS)

    Khurma, J.R.; Fenby, D.V.

    1979-01-01

    Molar excess enthalpies of water-alcohol systems have been analyzed to give equilibrium constants and enthalpies of the reactions 2ROH + D 2 O = 2ROD + H 2 O (R = CH 3 , C 2 H 5 , n-C 3 H 7 ). The equilibrium constants are significantly greater than the ''random'' value. Molar excess enthalpies of alcohol-alcohol systems have been analyzed to give enthalpies of reactions ROH + R'OD = ROD + R'OH. The enthalpies of water-alcohol and alcohol-alcohol exchange reactions form a self-consistent set and are in good agreement with values from earlier studies. Molar excess enthalpies at 298.15 K are reported for n-C 3 H 7 OH and n-C 3 H 7 OD with H 2 O, D 2 O, CH 3 OH, CH 3 OD, C 2 H 5 OH, and C 2 H 5 OD

  13. Factors influencing the alignment of accounting information systems of accepted manufacturing firms in Tehran Stock Exchange

    Directory of Open Access Journals (Sweden)

    Fazel Tamoradi

    2014-03-01

    Full Text Available The primary objective of this paper is to detect factors influencing the alignment of accounting information systems for firms in manufacturing sector listed on Tehran Stock Exchange. The concept of alignment has been investigated for many years, and strategic alignment plays essential role in increasing company performance. This paper investigates different levels of alignment and studies the factors, which influence alignment. More specifically, the work concentrates on the alignment between the requirements for accounting information (AIS requirements and the capacity of accounting systems (AIS capacity to build the information, in the specific context of manufacturing in Iran. The research sample consists of 216 companies over the period 2011-2007. The fit between these two sets was explored based on the moderation method and evidences indicate that AIS alignment in some firms was high. In addition, the relationship between the dependent variable and independent variables through multiple regressions yields a positive relationship between these variables.

  14. Impact of the picture exchange communication system: effects on communication and collateral effects on maladaptive behaviors.

    Science.gov (United States)

    Ganz, Jennifer B; Parker, Richard; Benson, Joanne

    2009-12-01

    Many children with autism require intensive instruction in the use of augmentative or alternative communication systems, such as the Picture Exchange Communication System (PECS). This study investigated the use of PECS with three young boys with autism to determine the impact of PECS training on use of pictures for requesting, use of intelligible words, and maladaptive behaviors. A multiple baseline-probe design with a staggered start was implemented. Results indicated that all of the participants quickly learned to make requests using pictures and that two used intelligible speech following PECS instruction; maladaptive behaviors were variable throughout baseline and intervention phases. Although all of the participants improved in at least one dependent variable, there remain questions regarding who is best suited for PECS and similar interventions.

  15. Data exchange technology based on handshake protocol for industrial automation system

    Science.gov (United States)

    Astafiev, A. V.; Shardin, T. O.

    2018-05-01

    In the article, questions of data exchange technology based on the handshake protocol for industrial automation system are considered. The methods of organizing the technology in client-server applications are analyzed. In the process of work, the main threats of client-server applications that arise during the information interaction of users are indicated. Also, a comparative analysis of analogue systems was carried out, as a result of which the most suitable option was chosen for further use. The basic schemes for the operation of the handshake protocol are shown, as well as the general scheme of the implemented application, which describes the entire process of interaction between the client and the server.

  16. Secure Data Exchange in Environmental Health Monitoring System through Wireless Sensor Network

    Directory of Open Access Journals (Sweden)

    Amang Sudarsono

    2016-04-01

    Full Text Available Recently, disseminating latest sensory information regarding the status of environmental health in the surroundings of human life is one of very important circumstances which must be known by everyone. These circumstances should be accessible at anytime and anywhere by everyone through any type of end-user devices, both fixed and mobile devices, i.e., Desktop PCs, Laptop PCs, and Smartphones. Wireless Sensor Network (WSN is one of the networks which deals with data sensors distribution from sensor nodes to the gateway node toward a Data Center Server. However, there is a big possibility for many adversaries to intercept and even manipulate data sensors crossing the network. Hence, a secure data sensor exchange in the system would be strongly desirable. In this research, we propose an environmental health conditions monitoring system through WSN and its implementation with considering secure data sensor exchange within the network and secure data sensor access. This work may contribute to support a part of smart cities and take in part the Internet of Thing (IoT technology. In our proposed system, we collect some environmental health information such as temperature, humidity, luminosity, noise, carbon monoxide (CO and carbon dioxide (CO2 from sensor nodes. We keep the confidentiality and integrity of transmitted data sensors propagating through IEEE802.15.4-based communication toward a gateway node. Further, the collected data sensors in the gateway are synchronized to the Data Center Server through a secure TCP/IP connection for permanently storing. At anytime and anywhere, only legitimated users who successfully pass-through an attribute-based authentication system are able to access the data sensors.

  17. The Influence of Organizational Systems on Information Exchange in Long-Term Care Facilities: An Institutional Ethnography.

    Science.gov (United States)

    Caspar, Sienna; Ratner, Pamela A; Phinney, Alison; MacKinnon, Karen

    2016-06-01

    Person-centered care is heavily dependent on effective information exchange among health care team members. We explored the organizational systems that influence resident care attendants' (RCAs) access to care information in long-term care (LTC) settings. We conducted an institutional ethnography in three LTC facilities. Investigative methods included naturalistic observations, in-depth interviews, and textual analysis. Practical access to texts containing individualized care-related information (e.g., care plans) was dependent on job classification. Regulated health care professionals accessed these texts daily. RCAs lacked practical access to these texts and primarily received and shared information orally. Microsystems of care, based on information exchange formats, emerged. Organizational systems mandated written exchange of information and did not formally support an oral exchange. Thus, oral information exchanges were largely dependent on the quality of workplace relationships. Formal systems are needed to support structured oral information exchange within and between the microsystems of care found in LTC. © The Author(s) 2016.

  18. CLAIM (CLinical Accounting InforMation)--an XML-based data exchange standard for connecting electronic medical record systems to patient accounting systems.

    Science.gov (United States)

    Guo, Jinqiu; Takada, Akira; Tanaka, Koji; Sato, Junzo; Suzuki, Muneou; Takahashi, Kiwamu; Daimon, Hiroyuki; Suzuki, Toshiaki; Nakashima, Yusei; Araki, Kenji; Yoshihara, Hiroyuki

    2005-08-01

    With the evolving and diverse electronic medical record (EMR) systems, there appears to be an ever greater need to link EMR systems and patient accounting systems with a standardized data exchange format. To this end, the CLinical Accounting InforMation (CLAIM) data exchange standard was developed. CLAIM is subordinate to the Medical Markup Language (MML) standard, which allows the exchange of medical data among different medical institutions. CLAIM uses eXtensible Markup Language (XML) as a meta-language. The current version, 2.1, inherited the basic structure of MML 2.x and contains two modules including information related to registration, appointment, procedure and charging. CLAIM 2.1 was implemented successfully in Japan in 2001. Consequently, it was confirmed that CLAIM could be used as an effective data exchange format between EMR systems and patient accounting systems.

  19. Atucha I nuclear power plant: repair works in QK02W01 moderator system heat exchanger

    International Nuclear Information System (INIS)

    Olivieri, Luis E.; Zanni, Pablo A.

    2000-01-01

    Atucha I nuclear power plant moderator system operates with highly radioactive heavy water, a pressure of 115 Bar and temperatures of about 200 C degrees. In March 2000, an increasing leakage of heavy water to the conventional thermal circuit was detected, conducting the plant to a shut down. The development of a number of actions and measures were taken, in order to plug this leakage. The leakage was found in a heat exchanger, which is located in a place of difficult access, with a high radiological yield and which, according to design, it was not considered to be mechanically repaired. It is a U bend tubes heat exchanger, weighting about 20 tons, and with a heavy water flow of 800 tons/h on the primary circuit, and 950 tons/h of ordinary water on the secondary side. Foreseeing this event, it had been designed and constructed special equipment and procedures, by means of a contract, with the Company INVAP SA. Repair works were carried out within a period of eighty-six (86) days, from which, forty five days were used to repair the component itself. A considerable amount of time was used to prepare simulators and the training of personnel. Due to the high radiological yield and the strict care of radiological standards, it was necessary the participation of 300 persons, integrating a collective dose of 4,86 Sv-m. It was necessary the construction of platforms and auxiliary stairs so as to make the work place accessible, as well as lifting and movement devices for heavy components, since this area does not have such kind of facilities. Welding and cutting machines remote controlled as well as manipulators which operated in front of the exchanger tube sheet were used. The aim was the reduction of dose values as much as possible. Special shielding were developed and in some cases it was necessary the adoption of drastic measures such as the cutting of bolts or pipes. The failure was detected and the tube was plugged. Also were plugged those tubes with wall thickness

  20. A novel cogeneration system: A proton exchange membrane fuel cell coupled to a heat transformer

    International Nuclear Information System (INIS)

    Huicochea, A.; Romero, R.J.; Rivera, W.; Gutierrez-Urueta, G.; Siqueiros, J.; Pilatowsky, I.

    2013-01-01

    This study focuses on the potential of a novel cogeneration system which consists of a 5 kW proton exchange membrane fuel cell (PEMFC) and an absorption heat transformer (AHT). The dissipation heat resulting from the operation of the PEMFC would be used to feed the absorption heat transformer, which is integrated to a water purification system. Therefore, the products of the proposed cogeneration system are heat, electricity and distilled water. The study includes a simulation for the PEMFC as well as experimental results obtained with an experimental AHT facility. Based on the simulation results, experimental tests were performed in order to estimate the performance parameters of the overall system. This is possible due to the matching in power and temperatures between the outlet conditions of the simulated fuel cell and the inlet requirements of the AHT. Experimental coefficients of performance are reported for the AHT as well as the overall cogeneration efficiency for the integrated system. The results show that experimental values of coefficient of performance of the AHT and the overall cogeneration efficiency, can reach up to 0.256 and 0.571, respectively. This represents an increment in 12.4% of efficiency, compared to the fuel cell efficiency working individually. This study shows that the combined use of AHT systems with a PEMFC is possible and it is a very feasible project to be developed in the Centro de Investigación en Energía (Centre of Energy Research), México.

  1. The charge exchange recombination diagnostic system on the DIII-D tokamak

    International Nuclear Information System (INIS)

    Gohil, P.; Burrell, K.H.; Groebner, R.J.; Kim, J.; Martin, W.C.; McKee, E.L.; Seraydarian, R.P.

    1991-11-01

    The charge exchange recombination (CER) diagnostic system on the DIII-D tokamak is used to make spatially and temporally resolved measurements of the ion temperature and toroidal and poloidal rotation velocities. This is performed through visible spectroscopic measurements of the Doppler broadened and Doppler shifted HE II 468.6 nm, the CVI 529.1 nm, and the BV 494.5 nm spectral lines which have been excited by charge exchange recombination interactions between the fully stripped ions and the neutral atoms from the heating beams. The plasma viewing optics comprises 32 viewing chords spanning a typical plasma minor radius of 63 cm across the midplane, of which 15 spatial chords span 4.2 cm at the plasma edge just within the separatrix and provide a chord-to-chord spatial resolution of 0.3 cm. Fast camera readout electronics can provide a temporal resolution of 260 μs per time slice, but the effective minimum integration time, at present, is 1 ms which is limited by the detected photon flux from the plasma and the decay times of the phosphors used on the multichannel plate image intensifiers. Significant changes in the edge plasma radial electric field at the L-H transition have been observed, as determined from the CER measurements, and these results are being extensively compared to theories which consider the effects of sheared electric fields on plasma turbulence. 13 refs., 10 figs

  2. Conceptual Design of a Condensing Heat Exchanger for Space Systems Using Porous Media

    Science.gov (United States)

    Hasan, Mohammad M.; Khan, Lutful I.; Nayagam, Vedha; Balasubramaniam, Ramaswamy

    2006-01-01

    Condensing heat exchangers are used in many space applications in the thermal and humidity control systems. In the International Space Station (ISS), humidity control is achieved by using a water cooled fin surface over which the moist air condenses, followed by "slurper bars" that take in both the condensate and air into a rotary separator and separates the water from air. The use of a cooled porous substrate as the condensing surface provides and attractive alternative that combines both heat removal as well as liquid/gas separation into a single unit. By selecting the pore sizes of the porous substrate a gravity independent operation may also be possible with this concept. Condensation of vapor into and on the porous surface from the flowing air and the removal of condensate from the porous substrate are the critical processes involved in the proposed concept. This paper describes some preliminary results of the proposed condensate withdrawal process and discusses the on-going design and development work of a porous media based condensing heat exchanger at the NASA Glenn Research Center in collaboration with NASA Johnson Space Center.

  3. Internal heat exchange in an ejector-compression solar refrigeration system with R142b

    Energy Technology Data Exchange (ETDEWEB)

    Hernandez, Joge I; Estrada, Claudio A; Best, Roberto [Centro de Investigacion en Energia, UNAM, Temixco, Morelos (Mexico); Dorantes Ruben, J [Departamento de Energia, UNAM Azcapotzalco, Mexico, D.F. (Mexico)

    2000-07-01

    One way to use more efficiently the actual energy transfer in the ejector-compression system, is the use of heat exchangers between some of the components. The inclusion of two heat exchangers, preheater and precooler, is considered in a basic ejector-compression refrigeration system with refrigerant 142b. This study accounts for the energy and exergy efficiencies. COP and {epsilon}, according to parameter variations such as ejector efficiency, generation temperature with different superheating, condensation temperature and heat exchangers effectiveness. As known, the most important parameters in ejector-compression system analysis are the entrain-ment ratio U and system efficiencies COP and {epsilon}. The highest system COP and {epsilon}, as the entrainment ratio U, correspond to the highest exchangers effectiveness, highest superheating generator temperatures, highest ejector efficiency and lowest condenser temperature. For the COP and {epsilon} ratios, their maxima correspond to the same independent variables aforementioned for one of the higher superheating generator temperatures. In this case, this result indicates that the exergy efficiency {epsilon} does not contradict the information given by energy efficiency COP. So, to select correctly and optimum design condition, is enough to employ the COP ratio, which maximum value for the data shown corresponds to a superheating generator temperature of about 110 Celsius degrees, that can only be reached by evacuated tubular collectors or CPC solar concentrators. [Spanish] Una forma de usar mas eficientemente la transferencia real de energia en el sistema eyector-compresion es el uso de intercambiadores de calor entre algunos de los componentes. La inclusion de dos intercambiadores de calor precalentador y pre-enfriador se considera en un sistema de refrigeracion eyector-compresion con refrigerante 142b. Este estudio toma en cuenta las eficiencias de energia y exergia, COP y {epsilon}, de acuerdo con las variaciones

  4. Potential for Small Unmanned Aircraft Systems Applications for Identifying Groundwater-Surface Water Exchange in a Meandering River Reach

    Science.gov (United States)

    Pai, H.; Malenda, H. F.; Briggs, M. A.; Singha, K.; González-Pinzón, R.; Gooseff, M. N.; Tyler, S. W.

    2017-12-01

    The exchange of groundwater and surface water (GW-SW), including dissolved constituents and energy, represents a critical yet challenging characterization problem for hydrogeologists and stream ecologists. Here we describe the use of a suite of high spatial resolution remote sensing techniques, collected using a small unmanned aircraft system (sUAS), to provide novel and complementary data to analyze GW-SW exchange. sUAS provided centimeter-scale resolution topography and water surface elevations, which are often drivers of exchange along the river corridor. Additionally, sUAS-based vegetation imagery, vegetation-top elevation, and normalized difference vegetation index mapping indicated GW-SW exchange patterns that are difficult to characterize from the land surface and may not be resolved from coarser satellite-based imagery. We combined these data with estimates of sediment hydraulic conductivity to provide a direct estimate of GW "shortcutting" through meander necks, which was corroborated by temperature data at the riverbed interface.

  5. Study of Hydrogen Consumption by Control System in Proton Exchange Membrane Fuel Cell

    International Nuclear Information System (INIS)

    Ros Emilia Rosli; Edy Herianto Majlan; Siti Afiqah Abd Hamid; Wan Ramli Wan Daud; Ramizi Mohamed; Dedi Rohendi

    2016-01-01

    Efficient operation results from a proper control strategy. In the operation and performance of a Proton Exchange Membrane Fuel Cell (PEMFC), the hydrogen gas flow rate is one of the most essential control parameter in addition to operating pressure, water management, temperature and humidity. This is because of the high cost and amount of energy are required to produce the purity hydrogen gas. In this paper, a Proportional Integral Derivative (PID) feedback control system is used to control the hydrogen flow rate. A strategy is adapted to balance the hydrogen use based on the loading requirements, especially during start-ups and sudden power demands. This system is implemented using National Instrument (NI) devices powered by the LabVIEW program. This is due to its simplicity and customization flexibility for measuring, processing and recording data. Designed structure allows the real-time implementation of a robust control law that is able to address the related nonlinearities and uncertainties without incurring a heavy computational load for the controller algorithm. While it facilitating a fast sampling rate according to the needs of the power system. Test results from the controller show that the new fuel control system provides good performance by reducing the amount of wasted hydrogen gas compared with that of the previous open loop system by 30 % to over 80 % saved by the varied load. This improvement is beneficial for any PEMFC that experiences fluctuating power demand, especially for vehicle applications. (author)

  6. Health and Environment Linked for Information Exchange in Atlanta (HELIX-Atlanta): A Pilot Tracking System

    Science.gov (United States)

    Rickman, Doug; Shire, J.; Qualters, J.; Mitchell, K.; Pollard, S.; Rao, R.; Kajumba, N.; Quattrochi, D.; Estes, M., Jr.; Meyer, P.; hide

    2009-01-01

    Objectives. To provide an overview of four environmental public health surveillance projects developed by CDC and its partners for the Health and Environment Linked for Information Exchange, Atlanta (HELIX-Atlanta) and to illustrate common issues and challenges encountered in developing an environmental public health tracking system. Methods. HELIX-Atlanta, initiated in October 2003 to develop data linkage and analysis methods that can be used by the National Environmental Public Health Tracking Network (Tracking Network), conducted four projects. We highlight the projects' work, assess attainment of the HELIX-Atlanta goals and discuss three surveillance attributes. Results. Among the major challenges was the complexity of analytic issues which required multidiscipline teams with technical expertise. This expertise and the data resided across multiple organizations. Conclusions:Establishing formal procedures for sharing data, defining data analysis standards and automating analyses, and committing staff with appropriate expertise is needed to support wide implementation of environmental public health tracking.

  7. CFD Modeling of Flow and Ion Exchange Kinetics in a Rotating Bed Reactor System

    DEFF Research Database (Denmark)

    Larsson, Hilde Kristina; Schjøtt Andersen, Patrick Alexander; Byström, Emil

    2017-01-01

    A rotating bed reactor (RBR) has been modeled using computational fluid dynamics (CFD). The flow pattern in the RBR was investigated and the flow through the porous material in it was quantified. A simplified geometry representing the more complex RBR geometry was introduced and the simplified...... model was able to reproduce the main characteristics of the flow. Alternating reactor shapes were investigated, and it was concluded that the use of baffles has a very large impact on the flows through the porous material. The simulations suggested, therefore, that even faster reaction rates could...... be achieved by making the baffles deeper. Two-phase simulations were performed, which managed to reproduce the deflection of the gas–liquid interface in an unbaffled system. A chemical reaction was implemented in the model, describing the ion-exchange phenomena in the porous material using four different...

  8. The Effectiveness of Picture Exchange Communication System on Behavioral Problems of Children with Autism

    Directory of Open Access Journals (Sweden)

    Maryam Mamaghanieh

    2011-04-01

    Full Text Available Objective: Autism is one the most disturbing neurodevelopmental disorders associated with variety behavioral problems including communication deficits. The present study is aimed to examine the effectiveness of the Picture Exchange Communication System (PECS on behavioral problems of autistic children. Materials & Methods: This study follows a quasi- experimental single subject A-B design. Four boys with autism (aged between 3-7 years were selected from the Center for the Treatment of Autistic Disorders, Tehran. They were received PECS training for duration of four months (42 session, three sessions per week. Direct observation assessment and Autism Treatment Evaluation Checklist were applied 6 times during the course of the study. Results: Separate set of analysis of the data reveled a positive effects of PECS on reduction of behavioral problems in three children, although, some differences were identified between them. Conclusion: Enhanced ability to communicate by PECS, would effectively reduce behavioral problems of children with Autism

  9. Down-Hole Heat Exchangers: Modelling of a Low-Enthalpy Geothermal System for District Heating

    Directory of Open Access Journals (Sweden)

    M. Carlini

    2012-01-01

    Full Text Available In order to face the growing energy demands, renewable energy sources can provide an alternative to fossil fuels. Thus, low-enthalpy geothermal plants may play a fundamental role in those areas—such as the Province of Viterbo—where shallow groundwater basins occur and conventional geothermal plants cannot be developed. This may lead to being fuelled by locally available sources. The aim of the present paper is to exploit the heat coming from a low-enthalpy geothermal system. The experimental plant consists in a down-hole heat exchanger for civil purposes and can supply thermal needs by district heating. An implementation in MATLAB environment is provided in order to develop a mathematical model. As a consequence, the amount of withdrawable heat can be successfully calculated.

  10. Anomalous isotope effects in the U(IV)-U(VI) exchange system

    International Nuclear Information System (INIS)

    Fujii, Yasuhiko; Nomura, Masao; Okamoto, Makoto; Onitsuka, Hatsuki; Nakanishi, Takashi.

    1992-01-01

    In previous papers, the enrichment of 236 U in the U(IV) - U(VI) chemical exchange system was found to be significantly smaller than the value estimated by the normal mass dependence enrichment of 235 U. Further experiments have been carried out in the present work to confirm the strange phenomenon of the isotopic anomaly in uranium enrichment. The results have indicated that the separation coefficient of 236 U is the same value as one previously reported. To confirm the anomaly of uranium isotope separation, α-ray spectrometry was implemented to check the enrichment behavior of 234 U. Although no theoretical explanation is given for the isotopic anomaly, this is favorable phenomenon for the re-enrichment of recycled uranium which contains isotopes 232 U and 236 U. (author)

  11. 26 CFR 1.1081-7 - Sale of stock or securities received upon exchange by members of system group.

    Science.gov (United States)

    2010-04-01

    ... 26 Internal Revenue 11 2010-04-01 2010-04-01 true Sale of stock or securities received upon.... Orders § 1.1081-7 Sale of stock or securities received upon exchange by members of system group. (a... which are members of the same system group consists of stock or securities issued by the corporation...

  12. Transient Performance of Air-cooled Condensing Heat Exchanger in Long-term Passive Cooling System during Decay Heat Load

    Energy Technology Data Exchange (ETDEWEB)

    Kim, Myoung Jun; Lee, Hee Joon [Kookmin University, Seoul (Korea, Republic of); Moon, Joo Hyung; Bae, Youngmin; Kim, Young-In [KAERI, Daejeon (Korea, Republic of)

    2015-05-15

    In the event of a 'loss of coolant accident'(LOCA) and a non-LOCA, the secondary passive cooling system would be activated to cool the steam in a condensing heat exchanger that is immersed in an emergency cooldown tank (ECT). Currently, the capacities of these ECTs are designed to be sufficient to remove the sensible and residual heat from the reactor coolant system for 72 hours after the occurrence of an accident. After the operation of a conventional passive cooling system for an extended period, however, the water level falls as a result of the evaporation from the ECT, as steam is emitted from the open top of the tank. Therefore, the tank should be refilled regularly from an auxiliary water supply system when the system is used for more than 72 hours. Otherwise, the system would fail to dissipate heat from the condensing heat exchanger due to the loss of the cooling water. Ultimately, the functionality of the passive cooling system would be seriously compromised. As a passive means of overcoming the water depletion in the tank, Kim et al. applied for a Korean patent covering the concept of a long-term passive cooling system for an ECT even after 72 hours. This study presents transient performance of ECT with installing air-cooled condensing heat exchanger under decay heat load. The cooling capacity of an air-cooled condensing heat exchanger was evaluated to determine its practicality.

  13. Prior-to-Secondary School Course Classification System: School Codes for the Exchange of Data (SCED). NFES 2011-801

    Science.gov (United States)

    National Forum on Education Statistics, 2011

    2011-01-01

    In this handbook, "Prior-to-Secondary School Course Classification System: School Codes for the Exchange of Data" (SCED), the National Center for Education Statistics (NCES) and the National Forum on Education Statistics have extended the existing secondary course classification system with codes and descriptions for courses offered at…

  14. Characterization of protein/ligand interactions by {sup 1}H/{sup 3}H exchange: application to the hAsf{sup 1}/ histone H{sup 3} complex; Caracterisation des interactions proteine / ligand par echange {sup 1}H/{sup 3}H: application au complexe entre la proteine hAsf{sup 1} et l'histone H{sup 3}

    Energy Technology Data Exchange (ETDEWEB)

    Mousseau, G

    2007-05-15

    In the first chapter will be exposed the main current methods of identification to high debit of the interactions protein-protein. Then the methods allowing to characterize the surfaces of interaction or to determine the structures of the complexes will be listed by discussing the main advantages and the inconveniences. Our approach of characterization of the zones of interaction protein-protein is a method of 'foot-printing' 1, based on the identification and radicals' quantification formed on the residues of proteins accessible to the water. The second chapter will so discuss the development of this method of radical identification using the atom of tritium as radioactive label. Our approach will finally be validated in the third chapter by applying it to the characterization of amino acids involved in the interaction enter the human protein anti silencing factor 1 (hAsf11-156) and a fragment of the histone H{sup 3}. (N.C.)

  15. Turkish Straits System and Southern Black Sea: Exchange. Mixing and Shelf / Canyon Interactions

    Science.gov (United States)

    Özsoy, Emin; Gürses, Özgür; Tutsak, Ersin

    2015-04-01

    Based largely on an experiment employing high-resolution measurements carried out in June-July 2013 and re-interpretation of past experiments, the oceanographic variability of the exchange through the Turkish Straits System (TSS) and the interactions with the southern Black Sea are revealed through CTD, ADCP, oxygen and light transmission measurements. The exchange flow is primarily governed by the complex topography spanning two narrow straits, wide continental shelf regions, steep slopes and numerous canyons connecting deep basins. Water properties and currents in the high energy environment depends on the mosaic of fine-scale processes and pathways. The TSS, often approximated as a two-layer system has a hydraulically controlled, upper ocean and straits intensified regime, leading to surface jets and bottom plumes participating in mixing and renewal processes. The exit of the 'Mediterranean effluent' onto the Black Sea past a sill overflow from the Bosphorus passes through two subsequent hydraulic jumps and proceeds along a narrow canyon that veers to the west clear of the greater Bosphorus Canyon finally cascading down the few small canyons. A diffusive spread from the bottom vein of salty water reforms to the east and spills down the Bosphorus Canyon. The suspended particulate signature of the cascade, as well as its influence in hydrography is traced over the shelf and slope waters and through the numerous canyons into deep water where the reformed flow is found to sustain signatures of the past evolution of intrusive waters. An evaluation of the processes is given with reference to model development carried out in parallel to the analyses of the measurements.

  16. Exergy analysis of single effect absorption refrigeration systems: The heat exchange aspect

    International Nuclear Information System (INIS)

    Joybari, Mahmood Mastani; Haghighat, Fariborz

    2016-01-01

    Highlights: • Exergy analysis of LiBr/H 2 O absorption systems with identical COP was carried out. • Exergy destruction rank: absorber followed by generator, condenser and evaporator. • Lower heat source and chilled water inlet temperature reduced exergy destruction. • Higher cooling water inlet temperature reduced exergy destruction. • Lower HTF mass flow rate increased exergy efficiency even for fixed system COP. - Abstract: The main limitation of conventional energy analysis for the thermal performance of energy systems is that this approach does not consider the quality of energy. On the other hand, exergy analysis not only provides information about the systems performance, but also it can specify the locations and magnitudes of losses. A number of studies investigated the effect of parameters such as the component temperature, and heat transfer fluid (HTF) temperature and mass flow rate on the exergetic performance of the same absorption refrigeration system; thus, reported different coefficient of performance (COP) values. However, in this study, the system COP was considered to remain constant during the investigation. This means comparing systems with different heat exchanger designs (based on HTF mass flow rate and temperature) having the same COP value. The effect of HTF mass flow rate and inlet temperature of the cooling water, chilled water and heat source on the outlet specific exergy and exergy destruction rate of each component was investigated. It was found that the lower HTF mass flow rate decreased exergy destruction of the corresponding component. Moreover, the lower temperature of heat source and chilled water inlet increased the system exergetic efficiency. That was also the case for the higher cooling water inlet temperature. Based on the analysis, since the absorber and condenser accounted for a large portion of the total exergy destruction, cooling tower modification with lower cooling water mass flow rate is recommended

  17. A system dynamics evaluation model: implementation of health information exchange for public health reporting.

    Science.gov (United States)

    Merrill, Jacqueline A; Deegan, Michael; Wilson, Rosalind V; Kaushal, Rainu; Fredericks, Kimberly

    2013-06-01

    To evaluate the complex dynamics involved in implementing electronic health information exchange (HIE) for public health reporting at a state health department, and to identify policy implications to inform similar implementations. Qualitative data were collected over 8 months from seven experts at New York State Department of Health who implemented web services and protocols for querying, receipt, and validation of electronic data supplied by regional health information organizations. Extensive project documentation was also collected. During group meetings experts described the implementation process and created reference modes and causal diagrams that the evaluation team used to build a preliminary model. System dynamics modeling techniques were applied iteratively to build causal loop diagrams representing the implementation. The diagrams were validated iteratively by individual experts followed by group review online, and through confirmatory review of documents and artifacts. Three casual loop diagrams captured well-recognized system dynamics: Sliding Goals, Project Rework, and Maturity of Resources. The findings were associated with specific policies that address funding, leadership, ensuring expertise, planning for rework, communication, and timeline management. This evaluation illustrates the value of a qualitative approach to system dynamics modeling. As a tool for strategic thinking on complicated and intense processes, qualitative models can be produced with fewer resources than a full simulation, yet still provide insights that are timely and relevant. System dynamics techniques clarified endogenous and exogenous factors at play in a highly complex technology implementation, which may inform other states engaged in implementing HIE supported by federal Health Information Technology for Economic and Clinical Health (HITECH) legislation.

  18. Patients’ Data Management System Protected by Identity-Based Authentication and Key Exchange

    Directory of Open Access Journals (Sweden)

    Alexandra Rivero-García

    2017-03-01

    Full Text Available A secure and distributed framework for the management of patients’ information in emergency and hospitalization services is proposed here in order to seek improvements in efficiency and security in this important area. In particular, confidentiality protection, mutual authentication, and automatic identification of patients are provided. The proposed system is based on two types of devices: Near Field Communication (NFC wristbands assigned to patients, and mobile devices assigned to medical staff. Two other main elements of the system are an intermediate server to manage the involved data, and a second server with a private key generator to define the information required to protect communications. An identity-based authentication and key exchange scheme is essential to provide confidential communication and mutual authentication between the medical staff and the private key generator through an intermediate server. The identification of patients is carried out through a keyed-hash message authentication code. Thanks to the combination of the aforementioned tools, a secure alternative mobile health (mHealth scheme for managing patients’ data is defined for emergency and hospitalization services. Different parts of the proposed system have been implemented, including mobile application, intermediate server, private key generator and communication channels. Apart from that, several simulations have been performed, and, compared with the current system, significant improvements in efficiency have been observed.

  19. Patients' Data Management System Protected by Identity-Based Authentication and Key Exchange.

    Science.gov (United States)

    Rivero-García, Alexandra; Santos-González, Iván; Hernández-Goya, Candelaria; Caballero-Gil, Pino; Yung, Moti

    2017-03-31

    A secure and distributed framework for the management of patients' information in emergency and hospitalization services is proposed here in order to seek improvements in efficiency and security in this important area. In particular, confidentiality protection, mutual authentication, and automatic identification of patients are provided. The proposed system is based on two types of devices: Near Field Communication (NFC) wristbands assigned to patients, and mobile devices assigned to medical staff. Two other main elements of the system are an intermediate server to manage the involved data, and a second server with a private key generator to define the information required to protect communications. An identity-based authentication and key exchange scheme is essential to provide confidential communication and mutual authentication between the medical staff and the private key generator through an intermediate server. The identification of patients is carried out through a keyed-hash message authentication code. Thanks to the combination of the aforementioned tools, a secure alternative mobile health (mHealth) scheme for managing patients' data is defined for emergency and hospitalization services. Different parts of the proposed system have been implemented, including mobile application, intermediate server, private key generator and communication channels. Apart from that, several simulations have been performed, and, compared with the current system, significant improvements in efficiency have been observed.

  20. Design and simulation of a hybrid ventilation system with earth-air heat exchanger

    Energy Technology Data Exchange (ETDEWEB)

    Athienitis, A.K.; Zhao, M. [Concordia Univ., Centre for Building Studies, Montreal, PQ (Canada). Dept. of Building, Civil and Environmental Engineering; Roy, M. [Martin Roy and Associes Group Conseil Inc., Montreal, PQ (Canada)

    2005-07-01

    A simulation study was conducted during the design phase of a new circus building in Montreal which includes a hybrid ventilation system through which fresh air is supplied from an earth-air heat exchanger (EAHE). The EAHE has the potential to satisfy the cooling needs of the building and can also be used to preheat fresh air, thereby satisfying one-third or more of the building's heating needs. Another feature of the building is that it uses displacement ventilation by which the air is supplied at low velocities through large diffusers behind the top level seats or under the seats. In this study, computational fluid dynamics (CFD) simulations were carried out to help size the supply and return units of the heating, ventilating and air conditioning (HVAC) system, as well as the exhaust chimney. The primary objective of the CFD simulation was to determine the maximum velocity and temperature in the seated area to ensure thermal comfort. CFD simulation predictions were found to be in good agreement with preliminary measurements taken in the building. In order to monitor the operation of the system over the next year, the underground ducts were equipped with temperature sensors at several depths into the soil. The energy efficiency of the hybrid HVAC system will be assessed and the velocity and temperature distribution in the theatre will be examined under various operating and energy load conditions. 8 refs., 6 figs.

  1. Patients’ Data Management System Protected by Identity-Based Authentication and Key Exchange

    Science.gov (United States)

    Rivero-García, Alexandra; Santos-González, Iván; Hernández-Goya, Candelaria; Caballero-Gil, Pino; Yung, Moti

    2017-01-01

    A secure and distributed framework for the management of patients’ information in emergency and hospitalization services is proposed here in order to seek improvements in efficiency and security in this important area. In particular, confidentiality protection, mutual authentication, and automatic identification of patients are provided. The proposed system is based on two types of devices: Near Field Communication (NFC) wristbands assigned to patients, and mobile devices assigned to medical staff. Two other main elements of the system are an intermediate server to manage the involved data, and a second server with a private key generator to define the information required to protect communications. An identity-based authentication and key exchange scheme is essential to provide confidential communication and mutual authentication between the medical staff and the private key generator through an intermediate server. The identification of patients is carried out through a keyed-hash message authentication code. Thanks to the combination of the aforementioned tools, a secure alternative mobile health (mHealth) scheme for managing patients’ data is defined for emergency and hospitalization services. Different parts of the proposed system have been implemented, including mobile application, intermediate server, private key generator and communication channels. Apart from that, several simulations have been performed, and, compared with the current system, significant improvements in efficiency have been observed. PMID:28362328

  2. The Deuterator: software for the determination of backbone amide deuterium levels from H/D exchange MS data

    Directory of Open Access Journals (Sweden)

    Tsinoremas NF

    2007-05-01

    Full Text Available Abstract Background The combination of mass spectrometry and solution phase amide hydrogen/deuterium exchange (H/D exchange experiments is an effective method for characterizing protein dynamics, and protein-protein or protein-ligand interactions. Despite methodological advancements and improvements in instrumentation and automation, data analysis and display remains a tedious process. The factors that contribute to this bottleneck are the large number of data points produced in a typical experiment, each requiring manual curation and validation, and then calculation of the level of backbone amide exchange. Tools have become available that address some of these issues, but lack sufficient integration, functionality, and accessibility required to address the needs of the H/D exchange community. To date there is no software for the analysis of H/D exchange data that comprehensively addresses these issues. Results We have developed an integrated software system for the automated analysis and representation of H/D exchange data that has been titled "The Deuterator". Novel approaches have been implemented that enable high throughput analysis, automated determination of deuterium incorporation, and deconvolution of overlapping peptides. This has been achieved by using methods involving iterative theoretical envelope fitting, and consideration of peak data within expected m/z ranges. Existing common file formats have been leveraged to allow compatibility with the output from the myriad of MS instrument platforms and peptide sequence database search engines. A web-based interface is used to integrate the components of The Deuterator that are able to analyze and present mass spectral data from instruments with varying resolving powers. The results, if necessary, can then be confirmed, adjusted, re-calculated and saved. Additional tools synchronize the curated calculation parameters with replicate time points, increasing throughput. Saved results can then

  3. Parametric analysis of an irreversible proton exchange membrane fuel cell/absorption refrigerator hybrid system

    International Nuclear Information System (INIS)

    Yang, Puqing; Zhang, Houcheng

    2015-01-01

    A hybrid system mainly consisting of a PEMFC (proton exchange membrane fuel cell) and an absorption refrigerator is proposed, where the PEMFC directly converts the chemical energy contained in the hydrogen into electrical and thermal energies, and the thermal energy is transferred to drive the bottoming absorption refrigerator for cooling purpose. By considering the existing irreversible losses in the hybrid system, the operating current density region of the PEMFC permits the absorption refrigerator to exert its function is determined and the analytical expressions for the equivalent power output and efficiency of the hybrid system under different operating conditions are specified. Numerical calculations show that the equivalent maximum power density and the corresponding efficiency of the hybrid system can be respectively increased by 5.3% and 6.8% compared to that of the stand-alone PEMFC. Comprehensive parametric analyses are conducted to reveal the effects of the internal irreversibility of the absorption refrigerator, operating current density, operating temperature and operating pressure of the PEMFC, and some integrated parameters related to the thermodynamic losses on the performance of the hybrid system. The model presented in the paper is more general than previous study, and the results for some special cases can be directly derived from this paper. - Highlights: • A CHP system composed of a PEMFC and an absorption refrigerator is proposed. • Current density region enables the absorption refrigerator to work is determined. • Multiple irreversible losses in the system are analytically characterized. • Maximum power density and corresponding efficiency can be increased by 5.3% and 6.8%. • Effects of some designing and operating parameters on the performance are discussed

  4. Simulation study of a proton exchange membrane (PEM) fuel cell system with autothermal reforming

    Energy Technology Data Exchange (ETDEWEB)

    Ersoz, Atilla [TUBITAK Marmara Research Centre, Energy Systems and Environmental Research Institute, 41470 Gebze, Kocaeli (Turkey); Olgun, Hayati [TUBITAK Marmara Research Centre, Energy Systems and Environmental Research Institute, 41470 Gebze, Kocaeli (Turkey); Ozdogan, Sibel [Marmara University, Faculty of Engineering, Department of Mechanical Engineering, 81040 Goztepe, Istanbul (Turkey)

    2006-08-15

    This paper presents the results of a study for a 100 kW net electrical power PEM fuel cell system. The major system components are an autothermal reformer, high and low temperature shift reactors, a preferential oxidation reactor, a PEM fuel cell, a combustor and an expander. Intensive heat integration within the PEM fuel cell system has been necessary to achieve acceptable net electrical efficiency levels. The calculations comprise the auxiliary equipment such as pumps, compressors, heaters, coolers, heat exchangers and pipes. The process simulation package 'ASPEN-HYSYS 3.1' has been used along with conventional calculations. The operation conditions of the autothermal reformer have been studied in detail to determine the values, which lead to the production of a hydrogen rich gas mixture with CO concentration at ppm level. The operation parameters of the other reactors have been determined considering the limitations implied by the catalysts involved. A gasoline type hydrocarbon fuel has been studied as the source for hydrogen production. The chemical composition of the hydrocarbon fuel affects the favorable operation conditions of autothermal reforming and the following fuel purification steps. Thermal efficiencies have been calculated for all of the major system components for selected operation conditions. The fuel cell stack efficiency has been calculated as a function of the number of cells (500-1250 cells). Efficiencies of all of the major system components along with auxiliary unit efficiencies determine the net electrical efficiency of the PEM fuel cell system. The obtained net electrical efficiency levels are between 30 (500 cells) and 37% (1250 cells). Hence, they are comparable with or higher than those of the conventional gasoline based internal combustion engine systems, in terms of the mechanical power efficiency.

  5. Simulation study of a proton exchange membrane (PEM) fuel cell system with autothermal reforming

    International Nuclear Information System (INIS)

    Ersoz, Atilla; Olgun, Hayati; Ozdogan, Sibel

    2006-01-01

    This paper presents the results of a study for a 100 kW net electrical power PEM fuel cell system. The major system components are an autothermal reformer, high and low temperature shift reactors, a preferential oxidation reactor, a PEM fuel cell, a combustor and an expander. Intensive heat integration within the PEM fuel cell system has been necessary to achieve acceptable net electrical efficiency levels. The calculations comprise the auxiliary equipment such as pumps, compressors, heaters, coolers, heat exchangers and pipes. The process simulation package 'ASPEN-HYSYS 3.1' has been used along with conventional calculations. The operation conditions of the autothermal reformer have been studied in detail to determine the values, which lead to the production of a hydrogen rich gas mixture with CO concentration at ppm level. The operation parameters of the other reactors have been determined considering the limitations implied by the catalysts involved. A gasoline type hydrocarbon fuel has been studied as the source for hydrogen production. The chemical composition of the hydrocarbon fuel affects the favorable operation conditions of autothermal reforming and the following fuel purification steps. Thermal efficiencies have been calculated for all of the major system components for selected operation conditions. The fuel cell stack efficiency has been calculated as a function of the number of cells (500-1250 cells). Efficiencies of all of the major system components along with auxiliary unit efficiencies determine the net electrical efficiency of the PEM fuel cell system. The obtained net electrical efficiency levels are between 30 (500 cells) and 37% (1250 cells). Hence, they are comparable with or higher than those of the conventional gasoline based internal combustion engine systems, in terms of the mechanical power efficiency

  6. System for processing ion exchange resin regeneration waste liquid in atomic power plant

    International Nuclear Information System (INIS)

    Onaka, Noriyuki; Tanno, Kazuo; Shoji, Saburo.

    1976-01-01

    Object: To reduce the quantity of radioactive waste to be solidified by recovering and repeatedly using sulfuric acid and sodium hydroxide which constitute the ion exchange resin regeneration waste liquid. Structure: Cation exchange resin regeneration waste liquid is supplied to an anion exchange film electrolytic dialyzer for recovering sulfuric acid through separation from impurity cations, while at the same time anion exchange resin regeneration waste liquid is supplied to a cation exchange film electrolytic dialyzer for recovering sodium hydroxide through separation from impurity anions. The sulfuric acid and sodium hydroxide thus recovered are condensed by a thermal condenser and then, after density adjustment, repeatedly used for the regeneration of the ion exchange resin. (Aizawa, K.)

  7. On the use of exchange rates as trading rules in a bilateral system of transferable discharge permits

    International Nuclear Information System (INIS)

    Rodriguez, F.

    2000-01-01

    The use of a system of transferable discharge permits to control the harmful effects of non-uniformly mixed pollutants requires the application of trading rules in order to prevent permit trading among sources from violating environmental standards. The elements and properties of bilateral trading rules can be analyzed more easily once formulated as exchange rates, which would convert, in a cost-effective way, the emission right potentially given up by the seller into an offsetting emission right acquired by the buyer. In this article, a new expression for such exchange rates is proposed and then analyzed to infer some unexplored properties of the system. 8 refs

  8. Patterns of exchange of forensic DNA data in the European Union through the Pr?m system

    OpenAIRE

    Santos, Filipe; Machado, Helena

    2017-01-01

    Article in press This paper presents a study of the 5-year operation (2011–2015) of the transnational exchange of forensic DNA data between Member States of the European Union (EU) for the purpose of combating cross-border crime and terrorism within the so-called Prüm system. This first systematisation of the full official statistical dataset provides an overall assessment of the match figures and patterns of operation of the Prüm system for DNA exchange. These figures and patterns are ana...

  9. Novel Wireless Sensor System for Dynamic Characterization of Borehole Heat Exchangers

    Directory of Open Access Journals (Sweden)

    Raimundo García-Olcina

    2011-07-01

    Full Text Available The design and field test of a novel sensor system based in autonomous wireless sensors to measure the temperature of the heat transfer fluid along a borehole heat exchanger (BHE is presented. The system, by means of two specials valves, inserts and extracts miniaturized wireless sensors inside the pipes of the borehole, which are carried by the thermal fluid. Each sensor is embedded in a small sphere of just 25 mm diameter and 8 gr weight, containing a transceiver, a microcontroller, a temperature sensor and a power supply. A wireless data processing unit transmits to the sensors the acquisition configuration before the measurements, and also downloads the temperature data measured by the sensor along its way through the BHE U-tube. This sensor system is intended to improve the conventional thermal response test (TRT and it allows the collection of information about the thermal characteristics of the geological structure of subsurface and its influence in borehole thermal behaviour, which in turn, facilitates the implementation of TRTs in a more cost-effective and reliable way.

  10. Vapor Compression and Thermoelectric Heat Pump Heat Exchangers for a Condensate Distillation System: Design and Experiment

    Science.gov (United States)

    Erickson, Lisa R.; Ungar, Eugene K.

    2013-01-01

    Maximizing the reuse of wastewater while minimizing the use of consumables is critical in long duration space exploration. One of the more promising methods of reclaiming urine is the distillation/condensation process used in the cascade distillation system (CDS). This system accepts a mixture of urine and toxic stabilizing agents, heats it to vaporize the water and condenses and cools the resulting water vapor. The CDS wastewater flow requires heating and its condensate flow requires cooling. Performing the heating and cooling processes separately requires two separate units, each of which would require large amounts of electrical power. By heating the wastewater and cooling the condensate in a single heat pump unit, mass, volume, and power efficiencies can be obtained. The present work describes and compares two competing heat pump methodologies that meet the needs of the CDS: 1) a series of mini compressor vapor compression cycles and 2) a thermoelectric heat exchanger. In the paper, the system level requirements are outlined, the designs of the two heat pumps are described in detail, and the results of heat pump performance tests are provided. A summary is provided of the heat pump mass, volume and power trades and a selection recommendation is made.

  11. Manipulation of Superparamagnetic Beads on Patterned Exchange-Bias Layer Systems for Biosensing Applications.

    Science.gov (United States)

    Ehresmann, Arno; Koch, Iris; Holzinger, Dennis

    2015-11-13

    A technology platform based on a remotely controlled and stepwise transport of an array arrangement of superparamagnetic beads (SPB) for efficient molecular uptake, delivery and accumulation in the context of highly specific and sensitive analyte molecule detection for the application in lab-on-a-chip devices is presented. The near-surface transport of SPBs is realized via the dynamic transformation of the SPBs' magnetic potential energy landscape above a magnetically stripe patterned Exchange-Bias (EB) thin film layer systems due to the application of sub-mT external magnetic field pulses. In this concept, the SPB velocity is dramatically influenced by the magnitude and gradient of the magnetic field landscape (MFL) above the magnetically stripe patterned EB substrate, the SPB to substrate distance, the magnetic properties of both the SPBs and the EB layer system, respectively, as well as by the properties of the external magnetic field pulses and the surrounding fluid. The focus of this review is laid on the specific MFL design in EB layer systems via light-ion bombardment induced magnetic patterning (IBMP). A numerical approach is introduced for the theoretical description of the MFL in comparison to experimental characterization via scanning Hall probe microscopy. The SPB transport mechanism will be outlined in terms of the dynamic interplay between the EB substrate's MFL and the pulse scheme of the external magnetic field.

  12. Manipulation of Superparamagnetic Beads on Patterned Exchange-Bias Layer Systems for Biosensing Applications

    Directory of Open Access Journals (Sweden)

    Arno Ehresmann

    2015-11-01

    Full Text Available A technology platform based on a remotely controlled and stepwise transport of an array arrangement of superparamagnetic beads (SPB for efficient molecular uptake, delivery and accumulation in the context of highly specific and sensitive analyte molecule detection for the application in lab-on-a-chip devices is presented. The near-surface transport of SPBs is realized via the dynamic transformation of the SPBs’ magnetic potential energy landscape above a magnetically stripe patterned Exchange-Bias (EB thin film layer systems due to the application of sub-mT external magnetic field pulses. In this concept, the SPB velocity is dramatically influenced by the magnitude and gradient of the magnetic field landscape (MFL above the magnetically stripe patterned EB substrate, the SPB to substrate distance, the magnetic properties of both the SPBs and the EB layer system, respectively, as well as by the properties of the external magnetic field pulses and the surrounding fluid. The focus of this review is laid on the specific MFL design in EB layer systems via light-ion bombardment induced magnetic patterning (IBMP. A numerical approach is introduced for the theoretical description of the MFL in comparison to experimental characterization via scanning Hall probe microscopy. The SPB transport mechanism will be outlined in terms of the dynamic interplay between the EB substrate’s MFL and the pulse scheme of the external magnetic field.

  13. A review of fault tolerant control strategies applied to proton exchange membrane fuel cell systems

    Science.gov (United States)

    Dijoux, Etienne; Steiner, Nadia Yousfi; Benne, Michel; Péra, Marie-Cécile; Pérez, Brigitte Grondin

    2017-08-01

    Fuel cells are powerful systems for power generation. They have a good efficiency and do not generate greenhouse gases. This technology involves a lot of scientific fields, which leads to the appearance of strongly inter-dependent parameters. This makes the system particularly hard to control and increases fault's occurrence frequency. These two issues call for the necessity to maintain the system performance at the expected level, even in faulty operating conditions. It is called "fault tolerant control" (FTC). The present paper aims to give the state of the art of FTC applied to the proton exchange membrane fuel cell (PEMFC). The FTC approach is composed of two parts. First, a diagnosis part allows the identification and the isolation of a fault; it requires a good a priori knowledge of all the possible faults. Then, a control part allows an optimal control strategy to find the best operating point to recover/mitigate the fault; it requires the knowledge of the degradation phenomena and their mitigation strategies.

  14. Current status and future prospects of an automated sample exchange system PAM for protein crystallography

    Science.gov (United States)

    Hiraki, M.; Yamada, Y.; Chavas, L. M. G.; Matsugaki, N.; Igarashi, N.; Wakatsuki, S.

    2013-03-01

    To achieve fully-automated and/or remote data collection in high-throughput X-ray experiments, the Structural Biology Research Centre at the Photon Factory (PF) has installed PF automated mounting system (PAM) for sample exchange robots at PF macromolecular crystallography beamlines BL-1A, BL-5A, BL-17A, AR-NW12A and AR-NE3A. We are upgrading the experimental systems, including the PAM for stable and efficient operation. To prevent human error in automated data collection, we installed a two-dimensional barcode reader for identification of the cassettes and sample pins. Because no liquid nitrogen pipeline in the PF experimental hutch is installed, the users commonly add liquid nitrogen using a small Dewar. To address this issue, an automated liquid nitrogen filling system that links a 100-liter tank to the robot Dewar has been installed on the PF macromolecular beamline. Here we describe this new implementation, as well as future prospects.

  15. Novel wireless sensor system for dynamic characterization of borehole heat exchangers.

    Science.gov (United States)

    Martos, Julio; Montero, Álvaro; Torres, José; Soret, Jesús; Martínez, Guillermo; García-Olcina, Raimundo

    2011-01-01

    The design and field test of a novel sensor system based in autonomous wireless sensors to measure the temperature of the heat transfer fluid along a borehole heat exchanger (BHE) is presented. The system, by means of two special valves, inserts and extracts miniaturized wireless sensors inside the pipes of the borehole, which are carried by the thermal fluid. Each sensor is embedded in a small sphere of just 25 mm diameter and 8 gr weight, containing a transceiver, a microcontroller, a temperature sensor and a power supply. A wireless data processing unit transmits to the sensors the acquisition configuration before the measurements, and also downloads the temperature data measured by the sensor along its way through the BHE U-tube. This sensor system is intended to improve the conventional thermal response test (TRT) and it allows the collection of information about the thermal characteristics of the geological structure of subsurface and its influence in borehole thermal behaviour, which in turn, facilitates the implementation of TRTs in a more cost-effective and reliable way.

  16. BNL ALARA Center experience with an information exchange system on dose control at nuclear power plants

    International Nuclear Information System (INIS)

    Baum, J.W.; Khan, T.A.

    1992-01-01

    The essential elements of an international information exchange system on dose control at nuclear power plants are summarized. Information was collected from literature abstracting services, by attending technical meetings, by circulating data collection forms, and through personal contacts. Data are assembled in various databases and periodically disseminated to several hundred interested participants through a variety of publications and at technical meetings. Immediate on-line access to the data is available to participants with modems, commercially available communications software, and a password that is provided by the Brookhaven National Laboratory (BNL) ALARA Center to authorized users of the system. Since January 1992, rapid access also has been provided to persons with fax machines. Some information is available for ''polling'' the BNL system at any time, and other data can be installed for polling on request. Most information disseminated to data has been through publications; however, new protocols, simplified by the ALARA Center staff, and the convenience of fax machines are likely to make the earlier availability of information through these mechanisms increasingly important

  17. Tools for designing the cooling system of a proton exchange membrane fuel cell

    International Nuclear Information System (INIS)

    Soupremanien, Ulrich; Le Person, Stéphane; Favre-Marinet, Michel; Bultel, Yann

    2012-01-01

    Proton exchange membrane fuel cell (PEMFC) requires a careful management of the heat distribution inside the stack. The proton exchange membrane is the most sensitive element of this thermal management and it must operate under specific conditions in order to increase the lifetime and also the output power of the fuel cell. These last decades, the enhancement of the output power of the PEMFC has led the manufacturers to greatly improve the heat transfer effectiveness for cooling such systems. In addition, homogenizing the bipolar plate temperature increases the lifetime of the system by limiting the occurrence of strong thermal gradients. In this context, using a fluid in boiling conditions to cool down the PEMFC seems to be very suitable for this purpose. In order to compare the thermal performances between a coolant used in single-phase flow or in boiling flow conditions, we have built an experimental set-up allowing the investigation of cooling flows for these two conditions. Moreover, the geometry of the cooling channels is one of the key parameters which allows the improvement of the thermal performances. Indeed, the size or the aspect ratio of these channels could be designed in order to decrease the thermal system response. The sizing of the fuel cell cooling system is of paramount importance in boiling flow conditions because it can modify, not only the pressure losses along the channel and the heat transfer coefficient like in a single-phase flow but also, the onset of nucleate boiling (ONB) and the dryout point or critical heat flux (CHF). Thus, in order to understand some heat transfer mechanisms, which are geometry-dependent, a parametric study was completed by considering flows in four different rectangular channels. Finally, this study allows a better insight on the optimization of the geometrical parameters which improve the thermal performances of a PEMFC, from a cooling strategy aspect point of view. - Highlights: ► Parameters for the using of a

  18. Modeling and optimization of the air system in polymer exchange membrane fuel cell systems

    Energy Technology Data Exchange (ETDEWEB)

    Bao, Cheng; Ouyang, Minggao [State Key Laboratory of Automotive Safety and Energy, Tsinghua University, Beijing 100084 (China); Yi, Baolian [Dalian Institute of Chemical Physics, CAS, Dalian 116023 (China)

    2006-06-01

    Stack and air system are the two most important components in the fuel cell system (FCS). It is meaningful to study their properties and the trade-off between them. In this paper, a modified one-dimensional steady-state analytical fuel cell model is used. The logarithmic mean of the inlet and the outlet oxygen partial pressure is adopted to avoid underestimating the effect of air stoichiometry. And the pressure drop model in the grid-distributed flow field is included in the stack analysis. Combined with the coordinate change preprocessing and analog technique, neural network is used to treat the MAP of compressor and turbine in the air system. Three kinds of air system topologies, the pure screw compressor, serial booster and exhaust expander are analyzed in this article. A real-code genetic algorithm is programmed to obtain the global optimum air stoichiometric ratio and the cathode outlet pressure. It is shown that the serial booster and expander with the help of exhaust recycling, can improve more than 3% in the FCS efficiency comparing to the pure screw compressor. As the net power increases, the optimum cathode outlet pressure keeps rising and the air stoichiometry takes on the concave trajectory. The working zone of the proportional valve is also discussed. This presented work is helpful to the design of the air system in fuel cell system. The steady-state optimum can also be used in the dynamic control. (author)

  19. Modeling and optimization of the air system in polymer exchange membrane fuel cell systems

    Science.gov (United States)

    Bao, Cheng; Ouyang, Minggao; Yi, Baolian

    Stack and air system are the two most important components in the fuel cell system (FCS). It is meaningful to study their properties and the trade-off between them. In this paper, a modified one-dimensional steady-state analytical fuel cell model is used. The logarithmic mean of the inlet and the outlet oxygen partial pressure is adopted to avoid underestimating the effect of air stoichiometry. And the pressure drop model in the grid-distributed flow field is included in the stack analysis. Combined with the coordinate change preprocessing and analog technique, neural network is used to treat the MAP of compressor and turbine in the air system. Three kinds of air system topologies, the pure screw compressor, serial booster and exhaust expander are analyzed in this article. A real-code genetic algorithm is programmed to obtain the global optimum air stoichiometric ratio and the cathode outlet pressure. It is shown that the serial booster and expander with the help of exhaust recycling, can improve more than 3% in the FCS efficiency comparing to the pure screw compressor. As the net power increases, the optimum cathode outlet pressure keeps rising and the air stoichiometry takes on the concave trajectory. The working zone of the proportional valve is also discussed. This presented work is helpful to the design of the air system in fuel cell system. The steady-state optimum can also be used in the dynamic control.

  20. On the mathematic simulation of the energy efficiency for heat exchangers with the systems of impingement plane-parallel jets

    Directory of Open Access Journals (Sweden)

    Haritonova Larisa

    2017-01-01

    Full Text Available The article gives the analytical generalization of the data on the energy efficiency for heat exchangers with the flat heat exchange surface to which systems of impact plane parallel jets are sent. Functional relations of specific power consumption (per unit of area, which were obtained for the first time using the techniques of the similarity law, for moving a heat carrier are shown with regard to design and operation factors. The regression equations representing a mathematical model of the process enable to carry out an analysis of various factors impact on the parameter to be determined. The obtained results can be used to optimize or to create the calculation techniques for new highly-efficient heat exchange devices with jet plane -parallel impingement systems and also to reduce power consumption for moving a heat carrier.

  1. Heat Exchanger/Humidifier Trade Study and Conceptual Design for the Constellation Space Suit Portable Life Support System Ventilation Subsystem

    Science.gov (United States)

    Paul, Heather L.; Sompayrac, Robert; Conger, Bruce; Chamberlain, Mateo

    2009-01-01

    As development of the Constellation Space Suit Element progresses, designing the most effective and efficient life support systems is critical. The baseline schematic analysis for the Portable Life Support System (PLSS) indicates that the ventilation loop will need some method of heat exchange and humidification prior to entering the helmet. A trade study was initiated to identify the challenges associated with conditioning the spacesuit breathing gas stream for temperature and water vapor control, to survey technological literature and resources on heat exchanger and humidifiers to provide solutions to the problems of conditioning the spacesuit breathing gas stream, and to propose potential candidate technologies to perform the heat exchanger and humidifier functions. This paper summarizes the results of this trade study and also describes the conceptual designs that NASA developed to address these issues.

  2. Nordic system for data and information exchange. Report from meetings with the authorities, and proposal for further work

    International Nuclear Information System (INIS)

    Walderhaug, T.; Rikisins, G.

    1996-11-01

    The EKO-4.2 project involves investigating approaches to setting up a new reliable system based on computer internet technology for exchange of information between the Nordic countries. According to the project plans this information exchange is to be based on bulletin board systems in the different countries. It was required that the system should not set any restriction of type of data or information to be exchanged, nor should it involve any standardization of data, and above all, it was not intended as an alert system. A bulletin board system is passive in the sense that no information is actually sent, instead it is the receiver who is responsible for approaching the information and transferring it to own system. This feature makes the system unsuitable for alert purposes. Since a potential system will have to be implemented by the authorities in the respective countries, the first part of the project was to survey their interest and emphasis. This was done in meetings in the different countries. The conclusion from those meetings was an overall interest in establishing a system as described, and several requirements concerning security and reliability of the system were proposed. The implication of the requirements by the authorities is discussed and a practical solution of an information exchange system based on the World Wide Web (WWW), the File Transfer Protocol (FTP), and the Internet is outlined. The continuation of the project must be based on operable servers in the different countries, whose configuration and connection with the local network are the responsibility of the institution owning the server. The selected system will depend on hardware and on the overall security policy of the institution involved. It is proposed that further work concentrates on a general testing of the system, standardizing of server user interfaces and testing of encryption software for transfer of passwords. (au)

  3. Data exchange between the este systems at the SUJB Prague and at the BMLFUW Vienna in case of emergency

    International Nuclear Information System (INIS)

    Carny, P.; Starostova, V.; Hofer, P.

    2005-01-01

    According to arrangement between the State Office for Nuclear Safety (SUJB) and the Federal Ministry of Agriculture and Forestry, Environment and Water Management, Radiation Protection Division (BMLFUW) there is prepared and regularly tested emergency data exchange between the ESTE systems at the SUJB and at the BMLFUW. The ESTE system is support instrument for off-site emergency response and its main goals in case of severe reactor accidents are: .detection of the way of the release from the reactor core to the environment .detection of the state of the reactor core, .prediction of the source term, .estimation of really observed release rate to the atmosphere, .calculations of radioactive clouds dispersion and radiological impacts assessments. The este systems are implemented at the Emergency Response Centre of the Czech Republic (SUJB) in Prague and Austrian versions are implemented at the Crisis Centre of the Austrian Republic (BMLFUW) in Vienna. The main objective of data exchange according to the above mentioned agreement is to extend bilateral information exchange and make a step in the direction of harmonizing emergency management in case of radiological accidents. Automatic data exchange between the este systems at the SUJB Prague and at the BMLFUW Vienna is performed for testing and training regularly once a month. This assists us to have the system ready in any time. (authors)

  4. Simulation and Design of Vehicle Exhaust Power Generation Systems: The Interaction Between the Heat Exchanger and the Thermoelectric Modules

    Science.gov (United States)

    Tao, Cong; Chen, Gang; Mu, Yu; Liu, Lisheng; Zhai, Pengcheng

    2015-06-01

    Vehicle exhaust power generation systems (VEPGS), mainly consisting of a heat exchanger, cooling system, thermoelectric modules (TEMs), and clamping device, have attracted wide interest and attention for power generation from waste heat. In this work, systematical research was conducted to investigate the thermal performance, power output, and thermal stress of a VEPGS by using the multifield coupling method. Different from previous research, this work simulates a model that integrates the heat exchanger and TEMs, focusing on the effect of the TEMs on the thermal performance of the heat exchanger. It is found that the TEMs have a significant effect on the thermal performance of the heat exchanger. When not considering the effects of the TEMs, the hot-end temperature of the TEMs would be seriously underestimated, which would result in underestimation of the power output of the VEPGS and the level of thermal stress of the TEMs. Meanwhile, when considering the effect of the TEMs, the hot-end temperature distribution exhibits significant changes, and its temperature uniformity is significantly improved. The results suggest that, in VEPGS design and optimization, the interaction between the heat exchanger and TEMs should be considered. This study also contributes to a more accurate assessment method for VEPGS design and simulation.

  5. General Systems Theory, Systems Analysis, and Regional Planning: An Introductory Bibliography. Exchange Bibliography No. 164.

    Science.gov (United States)

    Williams, Hugh E.

    This bibliography suggests a number of introductory readings that will enable regional and urban planners to understand the systems approach. The main focus of the research study that gave rise to this review of the literature was on establishing ways in which decisionmakers in regional planning could be helped in making their choices. The…

  6. The Development of a Patient-Identification-Oriented Nursing Shift Exchange Support System Using Wireless RFID PDA Techniques

    OpenAIRE

    Huang, Pin-Jen; She, Chien-Cheng; Chang, Polun

    2005-01-01

    The objectives of this study were to technically testing the feasibility of combining RFID and PDA technologies in nursing care and to develop a support system for the nursing shift exchange, which featured with “Positive Patient Identification” and “Point of Care” for patient’s safety and security. The most challenging part for the future work would be to embed the system into the real workflow. Future study would be to examine the practical effectiveness of the system....

  7. School Organization and Institutional Change: Exchange and Power in Loosely Coupled Systems.

    Science.gov (United States)

    Talbert, Joan E.

    This paper presents an exchange-theory view of school authority relations in order to identify patterns of coupling, or interdependencies, within school organizations and to analyze the potential for tighter coupling of administrative and teaching subsystems. The analysis proceeds from an argument that the social-exchange view of administrative…

  8. Analysis of a radiative heat exchanger for systems for thermal control of space vehicles

    International Nuclear Information System (INIS)

    Vasil'ev, L.L.; Kanonchik, L.E.; Babenko, V.A.

    1995-01-01

    Starting from the solution of a two-dimensional heat conduction problem, a mathematical model of a heat pipe-based radiative heat exchanger is developed. Good agreement between the predicted and experimental results is obtained. The effect of operational and structural parameters on the characteristics of the radiative heat exchanger is analyzed

  9. An Experimental Seismic Data and Parameter Exchange System for Tsunami Warning Systems

    Science.gov (United States)

    Hoffmann, T. L.; Hanka, W.; Saul, J.; Weber, B.; Becker, J.; Heinloo, A.; Hoffmann, M.

    2009-12-01

    For several years GFZ Potsdam is operating a global earthquake monitoring system. Since the beginning of 2008, this system is also used as an experimental seismic background data center for two different regional Tsunami Warning Systems (TWS), the IOTWS (Indian Ocean) and the interim NEAMTWS (NE Atlantic and Mediterranean). The SeisComP3 (SC3) software, developed within the GITEWS (German Indian Ocean Tsunami Early Warning System) project, capable to acquire, archive and process real-time data feeds, was extended for export and import of individual processing results within the two clusters of connected SC3 systems. Therefore not only real-time waveform data are routed to the attached warning centers through GFZ but also processing results. While the current experimental NEAMTWS cluster consists of SC3 systems in six designated national warning centers in Europe, the IOTWS cluster presently includes seven centers, with another three likely to join in 2009/10. For NEAMTWS purposes, the GFZ virtual real-time seismic network (GEOFON Extended Virtual Network -GEVN) in Europe was substantially extended by adding many stations from Western European countries optimizing the station distribution. In parallel to the data collection over the Internet, a GFZ VSAT hub for secured data collection of the EuroMED GEOFON and NEAMTWS backbone network stations became operational and first data links were established through this backbone. For the Southeast Asia region, a VSAT hub has been established in Jakarta already in 2006, with some other partner networks connecting to this backbone via the Internet. Since its establishment, the experimental system has had the opportunity to prove its performance in a number of relevant earthquakes. Reliable solutions derived from a minimum of 25 stations were very promising in terms of speed. For important events, automatic alerts were released and disseminated by emails and SMS. Manually verified solutions are added as soon as they become

  10. Use of subirrigation for water stress imposition in a semi-continuous CO2-exchange system

    Directory of Open Access Journals (Sweden)

    Rhuanito Soranz Ferrarezi

    2015-08-01

    Full Text Available The objectives of this work were to evaluate the effects of distinct moisture contents to trigger subirrigation on salvia photosynthesis and plant growth, and to verify the feasibility of subirrigation use in water stress imposition research in this crop. We evaluated two substrate volumetric water contents (VWC as treatments (0.2 and 0.4 m3 m-3 to trigger subirrigation, with 4 replications. Each replication was composed of 10 plants. An automated semi-continuous multi-chamber crop CO2-exchange system was used, with capacitance soil moisture sensors for continuous moisture monitoring. Manual subirrigation with nutrient solution was performed when VWC dropped below the thresholds. In both treatments, the values of net photosynthesis, daily carbon gain and carbon use efficiency reduced over time, from 2 to 1.1 μmol s-1 from 2.2 to 1 μmol d-1 from 0.7 to 0.45 mol mol-1, respectively, in both soil moisture treatments. Total shoot dry mass (p=0.0129, shoot height in the tip of the highest flower (p<0.0001 and total leaf area (p=0.0007 were statistically higher at 0.4 m3 m-3 treatment. The subirrigation system was not efficient to impose water stress, due to excessive variation on VWC values after each irrigation event in both treatments. Higher soil moisture promoted positive plant growth responses in salvia cultivated by subirrigation.

  11. Low-temperature nuclear magnetic resonance investigation of systems frustrated by competing exchange interactions

    Science.gov (United States)

    Roy, Beas

    This doctoral thesis emphasizes on the study of frustrated systems which form a very interesting class of compounds in physics. The technique used for the investigation of the magnetic properties of the frustrated materials is Nuclear Magnetic Resonance (NMR). NMR is a very novel tool for the microscopic study of the spin systems. NMR enables us to investigate the local magnetic properties of any system exclusively. The NMR experiments on the different systems yield us knowledge of the static as well as the dynamic behavior of the electronic spins. Frustrated systems bear great possibilities of revelation of new physics through the new ground states they exhibit. The vandates AA'VO(PO4)2 [AA' ≡ Zn2 and BaCd] are great prototypes of the J1-J2 model which consists of magnetic ions sitting on the corners of a square lattice. Frustration is caused by the competing nearest-neighbor (NN) and next-nearest neighbor (NNN) exchange interactions. The NMR investigation concludes a columnar antiferromagnetic (AFM) state for both the compounds from the sharp peak of the nuclear spin-lattice relaxation rate (1/T1) and a sudden broadening of the 31P-NMR spectrum. The important conclusion from our study is the establishment of the first H-P-T phase diagram of BaCdVO(PO4)2. Application of high pressure reduces the saturation field (HS) in BaCdVO(PO4)2 and decreases the ratio J2/J1, pushing the system more towards a questionable boundary (a disordered ground state) between the columnar AFM and a ferromagnetic ground state. A pressure up to 2.4 GPa will completely suppress HS. The Fe ions in the `122' iron-arsenide superconductors also sit on a square lattice thus closely resembling the J1-J2 model. The 75As-NMR and Nuclear Quadrupole Resonance (NQR) experiments are conducted in the compound CaFe2As2 prepared by two different heat treatment methods (`as-grown' and `annealed'). Interestingly the two samples show two different ground states. While the ground state of the `as

  12. Effects of picture exchange communication system on communication and behavioral anomalies in autism.

    Science.gov (United States)

    Malhotra, Shahzadi; Rajender, Gaurav; Bhatia, Manjeet S; Singh, Tej B

    2010-07-01

    Communication skills deficits and stereotyped behaviors are frequently found among people with pervasive developmental disabilities like autism. These communication and behavioral oddities of autism are often considered to be difficult to treat and are challenging. Picture exchange communication system (PECS) is a six-phase picture system based on applied behavior analysis and is specially designed to overcome these communication difficulties in children with autism by encouraging the child to be the communication initiator. The present paper throws light on the process of using PECS along with other traditional behavioral approaches in managing communication deficits and behavioral stereotypies in a seven-year-old male child diagnosed as having childhood autism. The identified target behaviors of repeated head turning, flapping his hands, poor communication skills were assessed using various rating scales including visual analogue scale as per clinician observation and parental reports and managed using PECS as an adjunct to traditional behavioral techniques of contingency management, differential reinforcement, task direction and reprimand. Outcome was assessed using same tools after thirty-two sessions of interventions spread over three months. Significant improvements of around 60% were observed in the target behaviors.

  13. Tuning of PID Controllers for Quadcopter System using Cultural Exchange Imperialist Competitive Algorithm

    Directory of Open Access Journals (Sweden)

    Nizar Hadi Abbas

    2018-02-01

    Full Text Available Quadrotors are coming up as an attractive platform for unmanned aerial vehicle (UAV research, due to the simplicity of their structure and maintenance, their ability to hover, and their vertical take-off and landing (VTOL capability. With the vast advancements in small-size sensors, actuators, and processors, researchers are now focusing on developing mini UAV’s to be used in both research and commercial applications. This work presents a detailed mathematical nonlinear dynamic model of the quadrotor which is formulated using the Newton-Euler method. Although the quadrotor is a 6 DOF under-actuated system, the derived rotational subsystem is fully actuated, while the translational subsystem is under-actuated. The derivation of the mathematical model was followed by the development of the controller to control the altitude, attitude, heading and position of the quadrotor in space, which is, based on the linear Proportional-Derivative- Integral (PID controller; thus, a simplified version of the model is obtained. The gains of the controllers will be tuned using optimization techniques to improve the system's dynamic response. The standard Imperialist Competitive Algorithm (ICA was applied to tune the PID parameters and then it was compared to Cultural Exchange Imperialist Competitive algorithm (CEICA tuning, and the results show improvement in the proposed algorithm. The objective function results were enhanced by (23.91% in the CEICA compared with ICA.

  14. A Study on Renin-Angiotensin System and Total Exchangeable Sodium in Hypertension

    International Nuclear Information System (INIS)

    Choe, Kang Won; Park, Jung Sik; Lee, Jung Sang; Koh, Chang Soon

    1976-01-01

    The etiologic role of renin-angiotensin system and sodium-volume status in the pathophysiology of various forms of hypertension was investigated. Plasma renin activity (PRA) was measured by radioimmunoassay, while sodium-volume status was evaluated by the determination of total exchangeable sodium(NaE) using isotope dilution method. The subjects consisted of 25 controls, 24 patients with essential hypertension, 22 patients with chronic renal failure (13 with hypertension, 9 without hypertension) and 14 patients with malignant hypertension. The results were as follows: 1) An inverse correlation between NaE and PRA was noted in control subjects (r=-0.598, p 0.1) 3) Absolute value of PRA was not deviated significantly from control group (2.53±1.416 ng/ml/hr) except in malignant hypertension (6.09±2.042, p 0.1). It is suggested that renin-angiotensin system plays a predominant role in the pathogenesis of malignant hypertension and in hypertension of chronic renal failure, though sodium retention is also contributing factor. PRA variation in essential hypertension does not appear to be associated with any consistent change in Na-volume status, suggesting the existence of another mechanism in the genesis of hypertension and PRA variation.

  15. An artificial neural network ensemble method for fault diagnosis of proton exchange membrane fuel cell system

    International Nuclear Information System (INIS)

    Shao, Meng; Zhu, Xin-Jian; Cao, Hong-Fei; Shen, Hai-Feng

    2014-01-01

    The commercial viability of PEMFC (proton exchange membrane fuel cell) systems depends on using effective fault diagnosis technologies in PEMFC systems. However, many researchers have experimentally studied PEMFC (proton exchange membrane fuel cell) systems without considering certain fault conditions. In this paper, an ANN (artificial neural network) ensemble method is presented that improves the stability and reliability of the PEMFC systems. In the first part, a transient model giving it flexibility in application to some exceptional conditions is built. The PEMFC dynamic model is built and simulated using MATLAB. In the second, using this model and experiments, the mechanisms of four different faults in PEMFC systems are analyzed in detail. Third, the ANN ensemble for the fault diagnosis is built and modeled. This model is trained and tested by the data. The test result shows that, compared with the previous method for fault diagnosis of PEMFC systems, the proposed fault diagnosis method has higher diagnostic rate and generalization ability. Moreover, the partial structure of this method can be altered easily, along with the change of the PEMFC systems. In general, this method for diagnosis of PEMFC has value for certain applications. - Highlights: • We analyze the principles and mechanisms of the four faults in PEMFC (proton exchange membrane fuel cell) system. • We design and model an ANN (artificial neural network) ensemble method for the fault diagnosis of PEMFC system. • This method has high diagnostic rate and strong generalization ability

  16. Abnormal swimming behavior and increased deformities in rainbow trout Oncorhynchus mykiss cultured in low exchange water recirculation aquaculture systems

    Science.gov (United States)

    Two studies were conducted to determine if accumulating water quality parameters would negatively impact rainbow trout Oncorhynchus mykiss health and welfare within water recirculation aquaculture systems (WRAS) that were operated at low and near-zero water exchange, with and without ozonation, and ...

  17. Two-phase plate-fin heat exchanger modeling for waste heat recovery systems in diesel engines

    NARCIS (Netherlands)

    Feru, E.; Jager, de A.G.; Willems, F.P.T.; Steinbuch, M.

    2014-01-01

    This paper presents the modeling and model validation for a modular two-phase heat exchanger that recovers energy in heavy-duty diesel engines. The model is developed for temperature and vapor quality prediction and for control design of the waste heat recovery system. In the studied waste heat

  18. A Novel Ion Exchange System to Purify Mixed ISS Waste Water Brines for Chemical Production and Enhanced Water Recovery

    Science.gov (United States)

    Lunn, Griffin; Spencer, LaShelle; Ruby, Anna-Maria; McCaskill, Andrew

    2014-01-01

    Current International Space Station water recovery regimes produce a sizable portion of waste water brine. This brine is highly toxic and water recovery is poor: a highly wasteful proposition. With new biological techniques that do not require waste water chemical pretreatment, the resulting brine would be chromium-free and nitrate rich which can allow possible fertilizer recovery for future plant systems. Using a system of ion exchange resins we can remove hardness, sulfate, phosphate and nitrate from these brines to leave only sodium and potassium chloride. At this point modern chlor-alkali cells can be utilized to produce a low salt stream as well as an acid and base stream. The first stream can be used to gain higher water recovery through recycle to the water separation stage while the last two streams can be used to regenerate the ion exchange beds used here, as well as other ion exchange beds in the ISS. Conveniently these waste products from ion exchange regeneration would be suitable as plant fertilizer. In this report we go over the performance of state of the art resins designed for high selectivity of target ions under brine conditions. Using ersatz ISS waste water we can evaluate the performance of specific resins and calculate mass balances to determine resin effectiveness and process viability. If this system is feasible then we will be one step closer to closed loop environmental control and life support systems (ECLSS) for current or future applications.

  19. 8 CFR 214.12 - Preliminary enrollment of schools in the Student and Exchange Visitor Information System (SEVIS).

    Science.gov (United States)

    2010-01-01

    ... of schools in the Student and Exchange Visitor Information System (SEVIS). (a) Private elementary and private secondary schools, public high schools, post-secondary schools, language schools, and vocational... 8 Aliens and Nationality 1 2010-01-01 2010-01-01 false Preliminary enrollment of schools in the...

  20. Teaching Children with Autism to Engage in Peer-Directed Mands Using a Picture Exchange Communication System

    Science.gov (United States)

    Paden, Amber R.; Kodak, Tiffany; Fisher, Wayne W.; Gawley-Bullington, Elizabeth M.; Bouxsein, Kelly J.

    2012-01-01

    We evaluated differential reinforcement of alternative behavior (DRA) plus prompting to increase peer-directed mands for preferred items using a picture exchange communication system (PECS). Two nonvocal individuals with autism participated. Independent mands with a peer increased with the implementation of DRA plus prompting for both…

  1. Augmentative and Alternative Communication in Autism: A Comparison of the Picture Exchange Communication System and Speech-Output Technology

    Science.gov (United States)

    Boesch, Miriam Chacon

    2011-01-01

    The purpose of this comparative efficacy study was to investigate the Picture Exchange Communication System (PECS) and a speech-generating device (SGD) in developing requesting skills, social-communicative behavior, and speech for three elementary-age children with severe autism and little to no functional speech. Requesting was selected as the…

  2. The Picture Exchange Communication System: Effects on Manding and Speech Development for School-Aged Children with Autism

    Science.gov (United States)

    Tincani, Matt; Crozier, Shannon; Alazett, Shannon

    2006-01-01

    We examined the effects of the Picture Exchange Communication System (PECS; Frost & Bondy, 2002) on the manding (requesting) and speech development of school-aged children with autism. In study 1, two participants, Damian and Bob, were taught PECS within a delayed multiple baseline design. Both participants demonstrated increased levels of manding…

  3. Comparative Efficacy of the Picture Exchange Communication System (PECS) versus a Speech-Generating Device: Effects on Requesting Skills

    Science.gov (United States)

    Boesch, Miriam C.; Wendt, Oliver; Subramanian, Anu; Hsu, Ning

    2013-01-01

    An experimental, single-subject research study investigated the comparative efficacy of the Picture Exchange Communication System (PECS) versus a speech-generating device (SGD) in developing requesting skills for three elementary-age children with severe autism and little to no functional speech. Results demonstrated increases in requesting…

  4. Effects of Iconicity on Requesting with the Picture Exchange Communication System in Children with Autism Spectrum Disorder

    Science.gov (United States)

    Angermeier, Katie; Schlosser, Ralf W.; Luiselli, James K.; Harrington, Caroline; Carter, Beth

    2008-01-01

    Research on graphic symbol learning suggests that symbols with a greater visual resemblance to their referents (greater iconicity) are more easily learned. The iconicity hypothesis has not yet been explored within the intervention protocol of the Picture Exchange Communication System (PECS). Within the PECS protocol, participants do not point to a…

  5. Brief Report: Increasing Communication Skills for an Elementary-Aged Student with Autism Using the Picture Exchange Communication System.

    Science.gov (United States)

    Kravits, Tamara R.; Kamps, Debra M.; Kemmerer, Katie; Potucek, Jessica

    2002-01-01

    Effects of the Picture Exchange Communication System on the spontaneous communication skills and social interactions of a 6-year-old girl with autism across her home and school environments were evaluated. Results indicated increases in spontaneous language, increases in intelligible verbalizations in two of three settings, and changes in peer…

  6. Picture Exchange Communication System with Individuals with Developmental Disabilities: A Meta-Analysis of Single Subject Studies

    Science.gov (United States)

    Hart, Stephanie L.; Banda, Devender R.

    2010-01-01

    Picture Exchange Communication System (PECS) is a picture-based communication strategy used to teach communication skills to persons with developmental disabilities including autism. This article systematically reviews 13 published single-subject studies to examine the effectiveness of PECS, the effects of PECS on speech and problem behaviors,…

  7. Effects of Implementing the Picture Exchange Communication System (PECS) with Adults with Developmental Disabilities and Severe Communication Deficits

    Science.gov (United States)

    Conklin, Carl G.; Mayer, G. Roy

    2011-01-01

    The purpose of this study is to evaluate the effects of "Picture Exchange Communication System" (PECS) training, using a multiple baseline design on the independent initiations of three adults with developmental disabilities and severe communication deficits. All participants increased their independent initiations, although at different…

  8. A Pilot Evaluation Study of the Picture Exchange Communication System (PECS) for Children with Autistic Spectrum Disorders.

    Science.gov (United States)

    Magiati, Iliana; Howlin, Patricia

    2003-01-01

    A study evaluated the effects of training 47 teachers of children with autism in the use of the Picture Exchange Communication System (PECS). Following training, significant, rapid increases were recorded in the level of PECS attained by the students (n=34), in students' PECS vocabulary, and in students' use of PECS. (Contains references.) (CR)

  9. Effect of Moisture Exchange on Interface Formation in the Repair System Studied by X-ray Absorption

    NARCIS (Netherlands)

    Lukovic, M.; Ye, G.

    2015-01-01

    In concrete repair systems, material properties of the repair material and the interface are greatly influenced by the moisture exchange between the repair material and the substrate. If the substrate is dry, it can absorb water from the repair material and reduce its effective water-to-cement ratio

  10. The impact of water exchange rate on the health and performance of rainbow trout Oncorhynchus mykiss in recirculation aquaculture systems

    Science.gov (United States)

    Fish mortality in recirculating aquaculture systems (RAS) has been observed by the authors to increase when RAS are managed at low makeup water exchange rates with relatively high feed loading. The precise etiology of this elevated mortality was unknown, all typical water quality parameters were wit...

  11. Effect of Moisture Exchange on Interface Formation in the Repair System Studied by X-ray Absorption

    Directory of Open Access Journals (Sweden)

    Mladena Lukovic

    2015-12-01

    Full Text Available In concrete repair systems, material properties of the repair material and the interface are greatly influenced by the moisture exchange between the repair material and the substrate. If the substrate is dry, it can absorb water from the repair material and reduce its effective water-to-cement ratio (w/c. This further affects the hydration rate of cement based material. In addition to the change in hydration rate, void content at the interface between the two materials is also affected. In this research, the influence of moisture exchange on the void content in the repair system as a function of initial saturation level of the substrate is investigated. Repair systems with varying level of substrate saturation are made. Moisture exchange in these repair systems as a function of time is monitored by the X-ray absorption technique. After a specified curing age (3 d, the internal microstructure of the repair systems was captured by micro-computed X-ray tomography (CT-scanning. From reconstructed images, different phases in the repair system (repair material, substrate, voids can be distinguished. In order to quantify the void content, voids were thresholded and their percentage was calculated. It was found that significantly more voids form when the substrate is dry prior to application of the repair material. Air, initially filling voids and pores of the dry substrate, is being released due to the moisture exchange. As a result, air voids remain entrapped in the repair material close to the interface. These voids are found to form as a continuation of pre-existing surface voids in the substrate. Knowledge about moisture exchange and its effects provides engineers with the basis for recommendations about substrate preconditioning in practice.

  12. Effect of Moisture Exchange on Interface Formation in the Repair System Studied by X-ray Absorption.

    Science.gov (United States)

    Lukovic, Mladena; Ye, Guang

    2015-12-22

    In concrete repair systems, material properties of the repair material and the interface are greatly influenced by the moisture exchange between the repair material and the substrate. If the substrate is dry, it can absorb water from the repair material and reduce its effective water-to-cement ratio (w/c). This further affects the hydration rate of cement based material. In addition to the change in hydration rate, void content at the interface between the two materials is also affected. In this research, the influence of moisture exchange on the void content in the repair system as a function of initial saturation level of the substrate is investigated. Repair systems with varying level of substrate saturation are made. Moisture exchange in these repair systems as a function of time is monitored by the X-ray absorption technique. After a specified curing age (3 d), the internal microstructure of the repair systems was captured by micro-computed X-ray tomography (CT-scanning). From reconstructed images, different phases in the repair system (repair material, substrate, voids) can be distinguished. In order to quantify the void content, voids were thresholded and their percentage was calculated. It was found that significantly more voids form when the substrate is dry prior to application of the repair material. Air, initially filling voids and pores of the dry substrate, is being released due to the moisture exchange. As a result, air voids remain entrapped in the repair material close to the interface. These voids are found to form as a continuation of pre-existing surface voids in the substrate. Knowledge about moisture exchange and its effects provides engineers with the basis for recommendations about substrate preconditioning in practice.

  13. STUDY ON ENERGY EXCHANGE PROCESSES IN NORMAL OPERATION OF METRO ROLLING STOCK WITH REGENERATIVE BRAKING SYSTEMS

    Directory of Open Access Journals (Sweden)

    A. O. Sulym

    2017-10-01

    Full Text Available Purpose. The analysis of the existing studies showed that the increasing of energy efficiency of metro rolling stock becomes especially important and requires timely solutions. It is known that the implementation of regenerative braking systems on rolling stock will allow significantly solving this problem. It was proved that one of the key issues regarding the introduction of the above-mentioned systems is research on efficient use of electric energy of regenerative braking. The purpose of the work is to evaluate the amount of excessive electric power of regenerative braking under normal operation conditions of the rolling stock with regenerative braking systems for the analysis of the energy saving reserves. Methodology. Quantifiable values of electrical energy consumed for traction, returned to the contact line and dissipated in braking resistors (excessive energy are determined using results of experimental studies of energy exchange processes under normal operating conditions of metro rolling stock with regenerative systems. Statistical methods of data processing were applied as well. Findings. Results of the studies analysis of metro rolling stock operation under specified conditions in Sviatoshinsko-Brovarskaia line of KP «Kyiv Metro system» stipulate the following: 1 introduction of regenerative braking systems into the rolling stock allows to return about 17.9-23.2% of electrical energy consumed for traction to the contact line; 2 there are reserves for improving of energy efficiency of rolling stock with regenerative systems at the level of 20.2–29.9 % of electrical energy consumed for traction. Originality. For the first time, it is proved that the most significant factor that influences the quantifiable values of the electrical energy regeneration is a track profile. It is suggested to use coefficients which indicate the amount and reserves of unused (excessive electrical energy for quantitative evaluation. Studies on

  14. Evaluation of several two-step scoring functions based on linear interaction energy, effective ligand size, and empirical pair potentials for prediction of protein-ligand binding geometry and free energy.

    Science.gov (United States)

    Rahaman, Obaidur; Estrada, Trilce P; Doren, Douglas J; Taufer, Michela; Brooks, Charles L; Armen, Roger S

    2011-09-26

    The performances of several two-step scoring approaches for molecular docking were assessed for their ability to predict binding geometries and free energies. Two new scoring functions designed for "step 2 discrimination" were proposed and compared to our CHARMM implementation of the linear interaction energy (LIE) approach using the Generalized-Born with Molecular Volume (GBMV) implicit solvation model. A scoring function S1 was proposed by considering only "interacting" ligand atoms as the "effective size" of the ligand and extended to an empirical regression-based pair potential S2. The S1 and S2 scoring schemes were trained and 5-fold cross-validated on a diverse set of 259 protein-ligand complexes from the Ligand Protein Database (LPDB). The regression-based parameters for S1 and S2 also demonstrated reasonable transferability in the CSARdock 2010 benchmark using a new data set (NRC HiQ) of diverse protein-ligand complexes. The ability of the scoring functions to accurately predict ligand geometry was evaluated by calculating the discriminative power (DP) of the scoring functions to identify native poses. The parameters for the LIE scoring function with the optimal discriminative power (DP) for geometry (step 1 discrimination) were found to be very similar to the best-fit parameters for binding free energy over a large number of protein-ligand complexes (step 2 discrimination). Reasonable performance of the scoring functions in enrichment of active compounds in four different protein target classes established that the parameters for S1 and S2 provided reasonable accuracy and transferability. Additional analysis was performed to definitively separate scoring function performance from molecular weight effects. This analysis included the prediction of ligand binding efficiencies for a subset of the CSARdock NRC HiQ data set where the number of ligand heavy atoms ranged from 17 to 35. This range of ligand heavy atoms is where improved accuracy of predicted ligand

  15. Ion exchange system design for removal of heavy metals from acid mine drainage wastewater

    Directory of Open Access Journals (Sweden)

    R. S. Sapkal

    2010-11-01

    Full Text Available This paper discusses the methodology used to determine the optimal ion-exchange column size to process all separate batchesof feeds from acid mine drainage wastewater.The optimal design ensures the best utilization of resin material and therefore results in a minimum amount of spent resins.Ion exchanger materials have been studied for removing heavy metals from a metal bearing wastes. For the current treatment,a facility has been designed for the removal of heavy metals from the acid mine drainage (AMD waste by the ion-exchange technology.

  16. A comparative study of different heat exchange systems in a thermoelectric refrigerator and their influence on the efficiency

    International Nuclear Information System (INIS)

    Astrain, D.; Aranguren, P.; Martínez, A.; Rodríguez, A.; Pérez, M.G.

    2016-01-01

    Highlights: • Total efficiency optimisation of a thermoelectric refrigerator. • Experimental study of three different types of heat exchangers for thermoelectrics. • Influence of the occupancy ratio in thermal resistance. • Important decrease in the electric consumption of a thermoelectric refrigerator. - Abstract: Thermoelectric refrigeration (TEC) exhibits several advantages compared to vapour-compression, since this technology presents accurate temperature control systems and higher levels of compactness, robustness and noiselessness. However, its low efficiency is acting as a deterrent for it to spread in the refrigeration market. One of the factors determining the efficiency of a thermoelectric refrigerator is the temperature difference between the hot and cold sides of the thermoelectric modules (TEMs). This is dependent on the thermal resistances of the heat exchangers used. This paper discusses the results of an experimental study of different types of heat exchangers for the thermoelectric module hot side: a water–air system comprising a cold plate, pump and fan coil; a finned heat sink with fan; a heat pipe with fan. Expressions of thermal resistance have been obtained for these three types as a function of the air and water mass flows and the number of TEMs per unit of surface area of heat exchanger (occupancy ratio, δ), as well as expressions of the power consumed by the fans and the pump. Finally, a computational study has been carried out on a thermoelectric refrigerator of 15 m"3 of interior volume, in order to obtain the influence of the heat exchanger studied, on the total consumption of the refrigerator and its efficiency. The results have demonstrated that relevant improvements can be made in TEC efficiency by the proper optimisation of the heat exchangers.

  17. Simulation and economic analysis of a liquid-based solar system with a direct-contact liquid-liquid heat exchanger, in comparison to a system with a conventional heat exchanger

    Science.gov (United States)

    Brothers, P.; Karaki, S.

    Using a solar computer simulation package called TRNSYS, simulations of the direct contact liquid-liquid heat exchanger (DCLLHE) solar system and a system with conventional shell-and-tube heat exchanger were developed, based in part on performance measurements of the actual systems. The two systems were simulated over a full year on an hour-by-hour basis at five locations; Boston, Massachusetts, Charleston, South Carolina, Dodge City, Kansas, Madison, Wisconsin, and Phoenix, Arizona. Typically the direct-contact system supplies slightly more heat for domestic hot water and space heating in all locations and about 5 percentage points more cooling as compared to the conventional system. Using a common set of economic parameters and the appropriate federal and state income tax credits, as well as property tax legislation for solar systems in the corresponding states, the results of the study indicate for heating-only systems, the DCLLHE system has a slight life-cycle cost disadvantage compared to the conventional system. For combined solar heating and cooling systems, the DCLLHE has a slight life-cycle cost advantage which varies with location and amounts to one to three percent difference from the conventional system.

  18. Prospect: A Picture Exchange Communication System (PECS)-based Instant Messaging Application for Autism Spectrum Condition

    Science.gov (United States)

    Raja, Pravind; Zainuri Saringat, Mohd; Mustapha, Aida; Zainal, Abidah

    2017-08-01

    Autism Spectrum Disorder (ASC) has widely gained the common attention from the public especially autistic communities. Individuals with ASC are said to have poor verbal skills and this affects them in carrying out their daily basis which they are afraid to expose themselves to the world due to their problems. ASC is diagnosed among children ranging from ages 5-12 years old and they suffer from the abnormal functioning of the brain which in turn causes lack of development activities. Thus, studies have shown that diagrammatic approaches help children with ASC to overcome their issues and improvise their visual and verbal skills. Picture Exchange Communication System or PECS consists of a series of illustrated cards and each cards has its own illustration with a caption on it. These children will understand the cards and they can compile several other cards to form sentences. This paper presents a mobile application called the Prospect, which has been developed using the agile development model for digital representation of PECS. The application is hoped to enhance the learning process and a better yielding results.

  19. Using adaptive neuro fuzzy inference system (ANFIS) for proton exchange membrane fuel cell (PEMFC) performance modeling

    International Nuclear Information System (INIS)

    Rezazadeh, S.; Mirzaee, I.; Mehrabi, M.

    2012-01-01

    In this paper, an adaptive neuro fuzzy inference system (ANFIS) is used for modeling proton exchange membrane fuel cell (PEMFC) performance using some numerically investigated and compared with those to experimental results for training and test data. In this way, current density I (A/cm 2 ) is modeled to the variation of pressure at the cathode side P C (atm), voltage V (V), membrane thickness (mm), Anode transfer coefficient α an , relative humidity of inlet fuel RH a and relative humidity of inlet air RH c which are defined as input (design) variables. Then, we divided these data into train and test sections to do modeling. We instructed ANFIS network by 80% of numerical validated data. 20% of primary data which had been considered for testing the appropriateness of the models was entered ANFIS network models and results were compared by three statistical criterions. Considering the results, it is obvious that our proposed modeling by ANFIS is efficient and valid and it can be expanded for more general states

  20. Using adaptive neuro fuzzy inference system (ANFIS) for proton exchange membrane fuel cell (PEMFC) performance modeling

    Energy Technology Data Exchange (ETDEWEB)

    Rezazadeh, S.; Mirzaee, I. [Urmia Univ., Urmia (Iran, Islamic Republic of); Mehrabi, M. [University of Pretoria, Pretoria (South Africa)

    2012-11-15

    In this paper, an adaptive neuro fuzzy inference system (ANFIS) is used for modeling proton exchange membrane fuel cell (PEMFC) performance using some numerically investigated and compared with those to experimental results for training and test data. In this way, current density I (A/cm{sup 2}) is modeled to the variation of pressure at the cathode side P{sup C} (atm), voltage V (V), membrane thickness (mm), Anode transfer coefficient {alpha}{sup an}, relative humidity of inlet fuel RH{sup a} and relative humidity of inlet air RH{sup c} which are defined as input (design) variables. Then, we divided these data into train and test sections to do modeling. We instructed ANFIS network by 80% of numerical validated data. 20% of primary data which had been considered for testing the appropriateness of the models was entered ANFIS network models and results were compared by three statistical criterions. Considering the results, it is obvious that our proposed modeling by ANFIS is efficient and valid and it can be expanded for more general states.

  1. Thermal modeling of a greenhouse integrated to an aquifer coupled cavity flow heat exchanger system

    Energy Technology Data Exchange (ETDEWEB)

    Sethi, V.P. [Department of Mechanical Engineering, Punjab Agricultural University, Ludhiana 141 008, Punjab (India); Sharma, S.K. [Energy Research Centre, Panjab University, Chandigarh 160 017, Punjab (India)

    2007-06-15

    A thermal model is developed for heating and cooling of an agricultural greenhouse integrated with an aquifer coupled cavity flow heat exchanger system (ACCFHES). The ACCFHES works on the principal of utilizing deep aquifer water available at the ground surface through an irrigation tube well already installed in every agricultural field at constant year-round temperature of 24 C. The analysis is based on the energy balance equations for different components of the greenhouse. Using the derived analytical expressions, a computer program is developed in C{sup ++} for computing the hourly greenhouse plant and room air temperature for various design and climatic parameters. Experimental validation of the developed model is carried out using the measured plant and room air temperature data of the greenhouse (in which capsicum is grown) for the winter and summer conditions of the year 2004-2005 at Chandigarh (31 N and 78 E), Punjab, India. It is observed that the predicted and measured values are in close agreement. Greenhouse room air and plant temperature is maintained 6-7 K and 5-6 K below ambient, respectively for an extreme summer day and 7-8 K and 5-6 K above ambient, respectively for an extreme winter night. Finally, parametric studies are conducted to observe the effect of various operating parameters such as mass of the plant, area of the plant, mass flow rate of the circulating air and area of the ACCFHES on the greenhouse room air and plant temperature. (author)

  2. Proton Exchange Membrane Fuel Cell/Supercapasitor Hybrid Power Management System for a Golf Cart

    International Nuclear Information System (INIS)

    Siti Afiqah Abd Hamid; Ros Emilia Rosli; Edy Herianto Majlan; Wan Ramli Wan Daud; Ramizi Mohamed; Ramli Sitanggang

    2016-01-01

    This paper presented the transformation of a golf cart system powered lead acid battery into an environmental friendly hybrid vehicle. The design developed by using an advantage contributes by the uprising alternative power source candidate which is Proton Exchange Membrane Fuel Cell (PEMFC) and the maintenance free energy storage device, a supercapacitor (SC). The fuel cell (FC) stack was an in house manufactured with 450 W (36 V, 12.5 A) power, while the SC was from Maxwell Technologies (48 V, 165 F). This two power sources were controlled by the mechanical relay, meanwhile the reactant (hydrogen) are control by mass flow controller (MFC) both signaled by a National Instrument (NI) devices. The power management controller are programmed in the LabVIEW environment and then downloaded to the NI devices. The experimental result of the power trend was compared before and after the transformation with the same route to validate the effectiveness of the proposed power management strategy. The power management successfully controls the power sharing between power sources and satisfies the load transient. While the reactant control managed to vary the hydrogen mass flow rate feed according to the load demand in vehicular applications. (author)

  3. Chlorine attack in copper/cupronickel heat exchangers tubes in service water system

    International Nuclear Information System (INIS)

    Hortiguela, Ruben; Corchon, Fernando; Villesccas, Gilberto

    2012-09-01

    Santa Maria de Garona is a nuclear power plant design BWR type 3 with an open cooling circuit without cooling towers which outlets to the Ebro river. In November 2006, the presence of zebra mussels was found upstream of the plant intake. The recommended option for the service water system was to install a chlorination treatment using liquid sodium hypochlorite. This recommendation was based primarily on the need to have an effective mitigation system in place at Garona in the summer of 2007. The recommendation was to apply continuous or semi-continuous addition of chlorine to the service water system, preventing any primary attachment of zebra mussels to the service water piping. The chlorine injection system was designed to deliver approximately 0,3 to 0,5 ppm Total Residual Chlorine (TRC) to the service water on continuous basis. The chlorine injection pumps located at the start of the service water system are controlled by the output of a chlorine analyzer located at the end of the service water system just prior to discharge. After four years injecting NaClO, numerous cases of tube failures in heat exchangers made of copper and cupronickel alloys have been detected. The reactions involved are as follows: Corrosion Reactions in Cupronickel alloys Cl 2 + Ni → NiCl 2 E=1.610 V (Pitting Initiator), Cl 2 + Cu → CuCl 2 E=1.023 V. Corrosion Reactions in Copper tubes Cl 2 + Cu → CuCl 2 E=1.023 V. A close examination by optical microscope of the internal wall of the tubes has shown the typical crystals created from chorine corrosion such as: Cu (OH) 2 , CuCl 2 . (2H 2 O),NiCl 2 , [CuCl 3 ] -1 and [CuCl 4 ] -2 Conclusions: The degradation of the material is due to a combination of the following items: - Ageing of material after many years of operation; - Erosion due to poor quality of river water (silica particles, silts, sediments, etc); - Attack from chlorination to base material; The solutions that have been implemented are mainly: - Reduction of chlorine

  4. DOE-EPSCoR. Exchange interactions in epitaxial intermetallic layered systems

    Energy Technology Data Exchange (ETDEWEB)

    LeClair, Patrick R. [Univ. of Alabama, Tuscaloosa, AL (United States); Gary, Mankey J. [Univ. of Alabama, Tuscaloosa, AL (United States)

    2015-05-25

    The goal of this research is to develop a fundamental understanding of the exchange interactions in epitaxial intermetallic alloy thin films and multilayers, including films and multilayers of Fe-Pt, Co-Pt and Fe-P-Rh alloys deposited on MgO and Al2O3 substrates. Our prior results have revealed that these materials have a rich variety of ferromagnetic, paramagnetic and antiferromagnetic phases which are sensitive functions of composition, substrate symmetry and layer thickness. Epitaxial antiferromagnetic films of FePt alloys exhibit a different phase diagram than bulk alloys. The antiferromagnetism of these materials has both spin ordering transitions and spin orienting transitions. The objectives include the study of exchange-inversion materials and the interface of these materials with ferromagnets. Our aim is to formulate a complete understanding of the magnetic ordering in these materials, as well as developing an understanding of how the spin structure is modified through contact with a ferromagnetic material at the interface. The ultimate goal is to develop the ability to tune the phase diagram of the materials to produce layered structures with tunable magnetic properties. The alloy systems that we will study have a degree of complexity and richness of magnetic phases that requires the use of the advanced tools offered by the DOE-operated national laboratory facilities, such as neutron and x-ray scattering to measure spin ordering, spin orientations, and element-specific magnetic moments. We plan to contribute to DOE’s mission of producing “Materials by Design” with properties determined by alloy composition and crystal structure. We have developed the methods for fabricating and have performed neutron diffraction experiments on some of the most interesting phases, and our work will serve to answer questions raised about the element-specific magnetizations using the magnetic x-ray dichroism techniques and interface magnetism in layered structures

  5. Rearrangeable and exchangeable optical module with system-on-chip for wearable functional near-infrared spectroscopy system.

    Science.gov (United States)

    Funane, Tsukasa; Numata, Takashi; Sato, Hiroki; Hiraizumi, Shinsuke; Hasegawa, Yuichi; Kuwabara, Hidenobu; Hasegawa, Kiyoshi; Kiguchi, Masashi

    2018-01-01

    We developed a system-on-chip (SoC)-incorporated light-emitting diode (LED) and avalanche photodiode (APD) modules to improve the usability and flexibility of a fiberless wearable functional near-infrared spectroscopy (fNIRS) system. The SoC has a microprocessing unit and programmable circuits. The time division method and the lock-in method were used for separately detecting signals from different positions and signals of different wavelengths, respectively. Each module autonomously works for this time-divided-lock-in measurement with a high sensitivity for haired regions. By supplying [Formula: see text] of power and base and data clocks, the LED module emits both 730- and 855-nm wavelengths of light, amplitudes of which are modulated in each lock-in frequency generated from the base clock, and the APD module provides the lock-in detected signals synchronizing with the data clock. The SoC provided many functions, including automatic-power-control of the LED, automatic judgment of detected power level, and automatic-gain-control of the programmable gain amplifier. The number and the arrangement of modules can be adaptively changed by connecting this exchangeable modules in a daisy chain and setting the parameters dependent on the probing position. Therefore, users can configure a variety of arrangements (single- or multidistance combinations) of them with this module-based system.

  6. Heat exchangers

    Energy Technology Data Exchange (ETDEWEB)

    Schmidt, E L; Eisenmann, G; Hahne, E [Stuttgart Univ. (TH) (F.R. Germany). Inst. fuer Thermodynamik und Waermetechnik

    1976-04-01

    A survey is presented on publications on design, heat transfer, form factors, free convection, evaporation processes, cooling towers, condensation, annular gap, cross-flowed cylinders, axial flow through a bundle of tubes, roughnesses, convective heat transfer, loss of pressure, radiative heat transfer, finned surfaces, spiral heat exchangers, curved pipes, regeneraters, heat pipes, heat carriers, scaling, heat recovery systems, materials selection, strength calculation, control, instabilities, automation of circuits, operational problems and optimization.

  7. Heat exchanger selection and design analyses for metal hydride heat pump systems

    DEFF Research Database (Denmark)

    Mazzucco, Andrea; Voskuilen, Tyler G.; Waters, Essene L.

    2016-01-01

    This study presents a design analysis for the development of highly efficient heat exchangers within stationary metal hydride heat pumps. The design constraints and selected performance criteria are applied to three representative heat exchangers. The proposed thermal model can be applied to select...... the most efficient heat exchanger design and provides outcomes generally valid in a pre-design stage. Heat transfer effectiveness is the principal performance parameter guiding the selection analysis, the results of which appear to be mildly (up to 13%) affected by the specific Nusselt correlation used....... The thermo-physical properties of the heat transfer medium and geometrical parameters are varied in the sensitivity analysis, suggesting that the length of independent tubes is the physical parameter that influences the performance of the heat exchangers the most. The practical operative regions for each...

  8. Monorail Piccolino catheter: a new rapid exchange/ultralow profile coronary angioplasty system.

    Science.gov (United States)

    Mooney, M R; Douglas, J S; Mooney, J F; Madison, J D; Brandenburg, R O; Fernald, R; Van Tassel, R A

    1990-06-01

    The Monorail Piccolino coronary angioplasty balloon catheter (MBC) was evaluated on 118 patients at two centers. Technical success was achieved in 110 patients (93%). Time for catheter exchange and total fluoroscopy time were significantly lower for the Monorail catheter than with standard equipment (exchange time 97 vs. 170 seconds P less than .05 and fluoroscopy time 17 vs. 88 seconds P less than .001). The advantages of rapid exchange and the ability of utilize 2 Monorail balloon catheters through one 9F guiding catheter for simultaneous inflations allowed for maximal flexibility in treating patients with bifurcation lesions. The double wire approach utilizing one Monorail balloon catheter with a 7F guiding catheter was also technically successful. The Monorail Piccolino balloon catheter has unique features that allow for greater ease of operator use, rapid catheter exchange, and optimal angiographic visualization. It is felt that this catheter design provides distinct advantages over standard angioplasty equipment.

  9. Data Description Exchange Services for Heterogeneous Vehicle and Spaceport Control and Monitor Systems, Phase II

    Data.gov (United States)

    National Aeronautics and Space Administration — CCT has designed and prototyped, as part of the Phase-1 SBIR, a generic platform independent software capability for exchange of semantic control and monitoring...

  10. A nuclear magnetic relaxation study of hydrogen exchange and water dynamics in aqueous systems

    International Nuclear Information System (INIS)

    Lankhorst, D.

    1983-01-01

    In this thesis exchange of water protons in solutions of some weak electrolytes and polyelectrolytes is studied. Also the dynamical behaviour of water molecules in pure water is investigated. For these purposes nuclear magnetic resonance relaxation measurements, in solutions of oxygen-17 enriched water, are interpreted. The exchange rate of the water protons is derived from the contribution of 1 H- 17 O scalar coupling to the proton transverse relaxation rate. This rate is measured by the Carr-Purcell technique. (Auth.)

  11. Seasonal and interannual variability of the water exchange in the Turkish Straits System estimated by modelling

    Directory of Open Access Journals (Sweden)

    V. MADERICH

    2015-07-01

    Full Text Available A chain of simple linked models is used to simulate the seasonal and interannual variability of the Turkish Straits System. This chain includes two-layer hydraulic models of the Bosphorus and Dardanelles straits simulating the exchange in terms of level and density difference along each strait, and a one-dimensional area averaged layered model of the Marmara Sea. The chain of models is complemented also by the similar layered model of the Black Sea proper and by a one-layer Azov Sea model with the Kerch Strait. This linked chain of models is used to study the seasonal and interannual variability of the system in the period 1970-2009. The salinity of the Black Sea water flowing into the Aegean Sea increases by approximately 1.7 times through entrainment from the lower layer. The flow entering into the lower layer of the Dardanelles Strait from the Aegean Sea is reduced by nearly 80% when it reaches the Black Sea. In the seasonal scale, a maximal transport in the upper layer and minimal transport in the bottom layer are during winter/spring for the Bosphorus and in spring for the Dardanelles Strait, whereas minimal transport in upper layer and maximal undercurrent are during the summer for the Bosphorus Strait and autumn for the Dardanelles Strait. The increase of freshwater flux into the Black Sea in interannual time scales (41 m3s-1 per year is accompanied by a more than twofold growth of the Dardanelles outflow to the North Aegean (102 m3s-1 per year.

  12. Data exchange between zero dimensional code and physics platform in the CFETR integrated system code

    Energy Technology Data Exchange (ETDEWEB)

    Xu, Guoliang [School of Nuclear Science and Technology, University of Science and Technology of China, Hefei 230026 China (China); Shi, Nan [Institute of Plasma Physics, Chinese Academy of Sciences, No. 350 Shushanhu Road, Hefei (China); Zhou, Yifu; Mao, Shifeng [School of Nuclear Science and Technology, University of Science and Technology of China, Hefei 230026 China (China); Jian, Xiang [State Key Laboratory of Advanced Electromagnetic Engineering and Technology, School of Electrical and Electronics Engineering, Huazhong University of Science and Technology, Wuhan 430074 (China); Chen, Jiale [Institute of Plasma Physics, Chinese Academy of Sciences, No. 350 Shushanhu Road, Hefei (China); Liu, Li; Chan, Vincent [School of Nuclear Science and Technology, University of Science and Technology of China, Hefei 230026 China (China); Ye, Minyou, E-mail: yemy@ustc.edu.cn [School of Nuclear Science and Technology, University of Science and Technology of China, Hefei 230026 China (China)

    2016-11-01

    Highlights: • The workflow of the zero dimensional code and the multi-dimension physics platform of CFETR integrated system codeis introduced. • The iteration process among the codes in the physics platform. • The data transfer between the zero dimensionalcode and the physical platform, including data iteration and validation, and justification for performance parameters.. - Abstract: The China Fusion Engineering Test Reactor (CFETR) integrated system code contains three parts: a zero dimensional code, a physics platform and an engineering platform. We use the zero dimensional code to identify a set of preliminary physics and engineering parameters for CFETR, which is used as input to initiate multi-dimension studies using the physics and engineering platform for design, verification and validation. Effective data exchange between the zero dimensional code and the physical platform is critical for the optimization of CFETR design. For example, in evaluating the impact of impurity radiation on core performance, an open field line code is used to calculate the impurity transport from the first-wall boundary to the pedestal. The impurity particle in the pedestal are used as boundary conditions in a transport code for calculating impurity transport in the core plasma and the impact of core radiation on core performance. Comparison of the results from the multi-dimensional study to those from the zero dimensional code is used to further refine the controlled radiation model. The data transfer between the zero dimensional code and the physical platform, including data iteration and validation, and justification for performance parameters will be presented in this paper.

  13. Soil temperature distribution around a U-tube heat exchanger in a multi-function ground source heat pump system

    International Nuclear Information System (INIS)

    Li Shuhong; Yang Weihua; Zhang Xiaosong

    2009-01-01

    The imbalance of heat extracted from the earth by the underground heat exchangers in winter and ejected into it in summer is expected to affect the long term performance of conventional ground source heat pump (GSHP) in territories with a cold winter and a warm summer such as the middle and downstream areas of the Yangtze River in China. This paper presents a new multi-function ground source heat pump (MFGSHP) system which supplies hot water as well as space cooling/heating to mitigate the soil imbalance of the extracted and ejected heat by a ground source heat pump system. The heat transfer characteristic is studied and the soil temperature around the underground heat exchangers are simulated under a typical climatic condition of the Yangtze River. A three-dimensional model was constructed with the commercial computational fluid dynamics software FLUENT based on the inner heat source theory. Temperature distribution and variation trend of a tube cluster of the underground heat exchanger are simulated for the long term performance. The results show that the soil temperature around the underground tube keeps increasing due to the surplus heat ejected into the earth in summer, which deteriorates the system performance and may lead to the eventual system deterioration. The simulation shows that MFGSHP can effectively alleviate the temperature rise by balancing the heat ejected to/extracted from underground by the conventional ground source heat pump system. The new system also improves the energy efficiency.

  14. Unlocking Chain Exchange in Highly Amphiphilic Block Polymer Micellar Systems: Influence of Agitation.

    Science.gov (United States)

    Murphy, Ryan P; Kelley, Elizabeth G; Rogers, Simon A; Sullivan, Millicent O; Epps, Thomas H

    2014-11-18

    Chain exchange between block polymer micelles in highly selective solvents, such as water, is well-known to be arrested under quiescent conditions, yet this work demonstrates that simple agitation methods can induce rapid chain exchange in these solvents. Aqueous solutions containing either pure poly(butadiene- b -ethylene oxide) or pure poly(butadiene- b -ethylene oxide- d 4 ) micelles were combined and then subjected to agitation by vortex mixing, concentric cylinder Couette flow, or nitrogen gas sparging. Subsequently, the extent of chain exchange between micelles was quantified using small angle neutron scattering. Rapid vortex mixing induced chain exchange within minutes, as evidenced by a monotonic decrease in scattered intensity, whereas Couette flow and sparging did not lead to measurable chain exchange over the examined time scale of hours. The linear kinetics with respect to agitation time suggested a surface-limited exchange process at the air-water interface. These findings demonstrate the strong influence of processing conditions on block polymer solution assemblies.

  15. Protein-ligand interfaces are polarized: discovery of a strong trend for intermolecular hydrogen bonds to favor donors on the protein side with implications for predicting and designing ligand complexes.

    Science.gov (United States)

    Raschka, Sebastian; Wolf, Alex J; Bemister-Buffington, Joseph; Kuhn, Leslie A

    2018-04-01

    Understanding how proteins encode ligand specificity is fascinating and similar in importance to deciphering the genetic code. For protein-ligand recognition, the combination of an almost infinite variety of interfacial shapes and patterns of chemical groups makes the problem especially challenging. Here we analyze data across non-homologous proteins in complex with small biological ligands to address observations made in our inhibitor discovery projects: that proteins favor donating H-bonds to ligands and avoid using groups with both H-bond donor and acceptor capacity. The resulting clear and significant chemical group matching preferences elucidate the code for protein-native ligand binding, similar to the dominant patterns found in nucleic acid base-pairing. On average, 90% of the keto and carboxylate oxygens occurring in the biological ligands formed direct H-bonds to the protein. A two-fold preference was found for protein atoms to act as H-bond donors and ligand atoms to act as acceptors, and 76% of all intermolecular H-bonds involved an amine donor. Together, the tight chemical and geometric constraints associated with satisfying donor groups generate a hydrogen-bonding lock that can be matched only by ligands bearing the right acceptor-rich key. Measuring an index of H-bond preference based on the observed chemical trends proved sufficient to predict other protein-ligand complexes and can be used to guide molecular design. The resulting Hbind and Protein Recognition Index software packages are being made available for rigorously defining intermolecular H-bonds and measuring the extent to which H-bonding patterns in a given complex match the preference key.

  16. Protein-ligand interfaces are polarized: discovery of a strong trend for intermolecular hydrogen bonds to favor donors on the protein side with implications for predicting and designing ligand complexes

    Science.gov (United States)

    Raschka, Sebastian; Wolf, Alex J.; Bemister-Buffington, Joseph; Kuhn, Leslie A.

    2018-02-01

    Understanding how proteins encode ligand specificity is fascinating and similar in importance to deciphering the genetic code. For protein-ligand recognition, the combination of an almost infinite variety of interfacial shapes and patterns of chemical groups makes the problem especially challenging. Here we analyze data across non-homologous proteins in complex with small biological ligands to address observations made in our inhibitor discovery projects: that proteins favor donating H-bonds to ligands and avoid using groups with both H-bond donor and acceptor capacity. The resulting clear and significant chemical group matching preferences elucidate the code for protein-native ligand binding, similar to the dominant patterns found in nucleic acid base-pairing. On average, 90% of the keto and carboxylate oxygens occurring in the biological ligands formed direct H-bonds to the protein. A two-fold preference was found for protein atoms to act as H-bond donors and ligand atoms to act as acceptors, and 76% of all intermolecular H-bonds involved an amine donor. Together, the tight chemical and geometric constraints associated with satisfying donor groups generate a hydrogen-bonding lock that can be matched only by ligands bearing the right acceptor-rich key. Measuring an index of H-bond preference based on the observed chemical trends proved sufficient to predict other protein-ligand complexes and can be used to guide molecular design. The resulting Hbind and Protein Recognition Index software packages are being made available for rigorously defining intermolecular H-bonds and measuring the extent to which H-bonding patterns in a given complex match the preference key.

  17. Determination of γ-hydroxybutyrate in human urine samples by ion exclusion and ion exchange two-dimensional chromatography system.

    Science.gov (United States)

    Liu, Junwei; Deng, Zhifen; Zhu, Zuoyi; Wang, Yong; Wang, Guoqing; Sun, Yu-An; Zhu, Yan

    2017-12-15

    A two-dimensional ion chromatography system was developed for the determination of γ-hydroxybutyrate (GHB) in human urine samples. Ion exclusion chromatography was used in the first dimensional separation for elimination of urine matrices and detection of GHB above 10mgL -1 , ion exchange chromatography was used in the second dimensional separation via column-switching technique for detection of GHB above 0.08mgL -1 . Under the optimized chromatographic conditions, the ion exclusion and ion exchange chromatography separation system exhibited satisfactory repeatability (RSDchromatography system was convenient and practical for the determination of GHB in human urine samples. Copyright © 2017 Elsevier B.V. All rights reserved.

  18. A Method for Optimal Load Dispatch of a Multi-zone Power System with Zonal Exchange Constraints

    Science.gov (United States)

    Hazarika, Durlav; Das, Ranjay

    2018-04-01

    This paper presented a method for economic generation scheduling of a multi-zone power system having inter zonal operational constraints. For this purpose, the generator rescheduling for a multi area power system having inter zonal operational constraints has been represented as a two step optimal generation scheduling problem. At first, the optimal generation scheduling has been carried out for the zone having surplus or deficient generation with proper spinning reserve using co-ordination equation. The power exchange required for the deficit zones and zones having no generation are estimated based on load demand and generation for the zone. The incremental transmission loss formulas for the transmission lines participating in the power transfer process among the zones are formulated. Using these, incremental transmission loss expression in co-ordination equation, the optimal generation scheduling for the zonal exchange has been determined. Simulation is carried out on IEEE 118 bus test system to examine the applicability and validity of the method.

  19. A run-around heat exchanger system to improve the energy efficiency of a home appliance using hot water

    International Nuclear Information System (INIS)

    Park, Jae Sung; Jacobi, Anthony M.

    2009-01-01

    A significant portion of the energy consumed by many home appliances using hot water is used to heat cold supply water. Such home appliances generally are supplied water at a temperature lower than the ambient temperature, and the supply water is normally heated to its maximum operating temperature, often using natural gas or an electrical heater. In some cases, it is possible to pre-heat the supply water and save energy that would normally be consumed by the natural gas or electrical heater. In order to save the energy consumed by an appliance using water heater, a run-around heat exchanger system is used to transfer heat from the ambient to the water before an electrical heater is energized. A simple model to predict the performance of this system is developed and validated, and the model is used to explore design and operating issues relevant to the run-around heat exchanger system. Despite the additional power consumption by the fan and pump of the run-around heat exchanger system, the experimental data and analysis show that for some systems the overall energy efficiency of the appliance can be improved, saving about 6% of the energy used by the baseline machine.

  20. New waste heat district heating system with combined heat and power based on absorption heat exchange cycle in China

    International Nuclear Information System (INIS)

    Sun Fangtian; Fu Lin; Zhang Shigang; Sun Jian

    2012-01-01

    A new waste heat district heating system with combined heat and power based on absorption heat exchange cycle (DHAC) was developed to increase the heating capacity of combined heat and power (CHP) through waste heat recovery, and enhance heat transmission capacity of the existing primary side district heating network through decreasing return water temperature by new type absorption heat exchanger (AHE). The DHAC system and a conventional district heating system based on CHP (CDH) were analyzed in terms of both thermodynamics and economics. Compared to CDH, the DHAC increased heating capacity by 31% and increased heat transmission capacity of the existing primary side district heating network by 75%. The results showed that the exergetic efficiency of DHAC was 10.41% higher and the product exergy monetary cost was 36.6¥/GJ less than a CHD. DHAC is an effective way to increase thermal utilization factor of CHP, and to reduce district heating cost. - Highlights: ► Absorption heat pumps are used to recover waste heat in CHP. ► Absorption heat exchanger can reduce exergy loss in the heat transfer process. ► New waste heat heating system (DHAC) can increase heating capacity of CHP by 31%. ► DHAC can enhance heat transmission capacity of the primary pipe network by 75%. ► DHAC system has the higher exergetic efficiency and the better economic benefit.

  1. Soil-atmosphere greenhouse-gas exchange in a bioretention system

    Science.gov (United States)

    Daly, E.; Chan, H.; Beringer, J.; Livesley, S. J.

    2011-12-01

    Bioretention systems are a popular green-technology for the management of urban stormwater runoff in many countries. They typically consist of a trench filled with a highly permeable soil medium that supports vegetation; runoff is diverted to bioretention systems and, by percolating through the filter medium, is subjected to a number of treatment processes. Nitrogen (N) is one of the key pollutants targeted by bioretention systems, which are able to reduce N concentrations considerably from inflow to outflow. To increase N removal, a saturated zone at the bottom of the filter medium is often artificially generated, to both enhance the denitrification process and increase the water available to the vegetation between inflow events. Although studies on the N-removal performance of bioretention systems are widely available in the literature, less is known about the exchange of greenhouse gases (GHG), especially nitrous oxide (N2O), between the bioretention systems and the atmosphere. Here, we present an experimental pilot study to measure N2O and CO2 soil emissions in a bioretention system installed on the Clayton Campus of Monash University in Melbourne, Australia. The bioretention system is divided into three cells, each 15 m2; the system as a whole receives water run-off from 4500 m2 of impervious car park. We monitored two cells with mostly sandy-loam vegetated with native sedges (mainly Carex Appressa and Lomandra Longifolia), one with and one without a saturated zone. Three manual flux chambers were installed in both cells. Gas flux samples were taken twice a week at about 11 am between the 2nd of March and the 18th of May 2011 (late summer and fall). Since October 2010, air-phase soil CO2 concentration profiles were measured continuously using solid-state infrared CO2 transmitters (GMT-221 model, Vaisala, Finland), along with soil moisture and soil temperature. Preliminary analysis of the chamber data (March only) showed that N2O fluxes were in general below 50

  2. Social-communicative effects of the Picture Exchange Communication System (PECS) in autism spectrum disorders.

    Science.gov (United States)

    Lerna, Anna; Esposito, Dalila; Conson, Massimiliano; Russo, Luigi; Massagli, Angelo

    2012-01-01

    The Picture Exchange Communication System (PECS) is a common treatment choice for non-verbal children with autism. However, little empirical evidence is available on the usefulness of PECS in treating social-communication impairments in autism. To test the effects of PECS on social-communicative skills in children with autism, concurrently taking into account standardized psychometric data, standardized functional assessment of adaptive behaviour, and information on social-communicative variables coded in an unstructured setting. Eighteen preschool children (mean age = 38.78 months) were assigned to two intervention approaches, i.e. PECS and Conventional Language Therapy (CLT). Both PECS (Phases I-IV) and CLT were delivered three times per week, in 30-min sessions, for 6 months. Outcome measures were the following: Autism Diagnostic Observation Schedule (ADOS) domain scores for Communication and Reciprocal Social Interaction; Language and Personal-Social subscales of the Griffiths' Mental Developmental Scales (GMDS); Communication and Social Abilities domains of the Vineland Adaptive Behavior Scales (VABS); and several social-communicative variables coded in an unstructured setting. Results demonstrated that the two groups did not differ at Time 1 (pre-treatment assessment), whereas at Time 2 (post-test) the PECS group showed a significant improvement with respect to the CLT group on the VABS social domain score and on almost all the social-communicative abilities coded in the unstructured setting (i.e. joint attention, request, initiation, cooperative play, but not eye contact). These findings showed that PECS intervention (Phases I-IV) can improve social-communicative skills in children with autism. This improvement is especially evident in standardized measures of adaptive behaviour and measures derived from the observation of children in an unstructured setting. © 2012 Royal College of Speech and Language Therapists.

  3. Predicting progress in Picture Exchange Communication System (PECS) use by children with autism.

    Science.gov (United States)

    Pasco, Greg; Tohill, Christina

    2011-01-01

    The Picture Exchange Communication System (PECS) is a widely used communication intervention for non-verbal children with autism spectrum disorder. Findings for the benefits of PECS have almost universally been positive, although there is very limited information about the characteristics of PECS users that determine the amount of progress that they are likely to make. To explore the utility of using children's developmental age to predict the subsequent degree of progress using PECS. In a retrospective study, 23 non-verbal 5- and 6-year-old children with autism spectrum disorder attending a special school were assessed to determine their highest level of PECS ability. They were then allocated to one of two groups depending on whether or not they had mastered PECS phase III. All participants had been assessed using the Psycho-Educational Profile-Revised (PEP-R) on entry to the school and before being introduced to PECS. Total developmental age scores were examined to determine whether they accurately predicted membership of the two PECS ability groups. All the 16 children who had mastered PECS phase III had total developmental age scores of 16 months or above, whilst six of the seven children who had not progressed beyond phase III scored below 16 months--the other child had a score of 16 months. The assessment of the developmental level of potential PECS users may provide valuable predictive information for speech-and-language therapists and other professionals in relation to the likely degree of progress and in setting realistic and achievable targets. © 2010 Royal College of Speech & Language Therapists.

  4. A novel pump-driven veno-venous gas exchange system during extracorporeal CO2-removal.

    Science.gov (United States)

    Hermann, Alexander; Riss, Katharina; Schellongowski, Peter; Bojic, Andja; Wohlfarth, Philipp; Robak, Oliver; Sperr, Wolfgang R; Staudinger, Thomas

    2015-10-01

    Pump-driven veno-venous extracorporeal CO2-removal (ECCO2-R) increasingly takes root in hypercapnic lung failure to minimize ventilation invasiveness or to avoid intubation. A recently developed device (iLA activve(®), Novalung, Germany) allows effective decarboxylation via a 22 French double lumen cannula. To assess determinants of gas exchange, we prospectively evaluated the performance of ECCO2-R in ten patients receiving iLA activve(®) due to hypercapnic respiratory failure. Sweep gas flow was increased in steps from 1 to 14 L/min at constant blood flow (phase 1). Similarly, blood flow was gradually increased at constant sweep gas flow (phase 2). At each step gas transfer via the membrane as well as arterial blood gas samples were analyzed. During phase 1, we observed a significant increase in CO2 transfer together with a decrease in PaCO2 levels from a median of 66 mmHg (range 46-85) to 49 (31-65) mmHg from 1 to 14 L/min sweep gas flow (p gas flow rates. During phase 2, oxygen transfer significantly increased leading to an increase in PaO2 from 67 (49-87) at 0.5 L/min to 117 (66-305) mmHg at 2.0 L/min (p gas flow results in effective CO2-removal, which can be further reinforced by raising blood flow. The clinically relevant oxygenation effect in this setting could broaden the range of indications of the system and help to set up an individually tailored configuration.

  5. Active heat exchange system development for latent heat thermal energy storage

    Science.gov (United States)

    Lefrois, R. T.; Mathur, A. K.

    1980-01-01

    Five tasks to select, design, fabricate, test and evaluate candidate active heat exchanger modules for future applications to solar and conventional utility power plants were discussed. Alternative mechanizations of active heat exchange concepts were analyzed for use with heat of fusion phase change materials (PCMs) in the temperature range of 250 to 350 C. Twenty-six heat exchange concepts were reviewed, and eight were selected for detailed assessment. Two candidates were selected for small-scale experimentation: a coated tube and shell heat exchanger and a direct contact reflux boiler. A dilute eutectic mixture of sodium nitrate and sodium hydroxide was selected as the PCM from over 50 candidate inorganic salt mixtures. Based on a salt screening process, eight major component salts were selected initially for further evaluation. The most attractive major components in the temperature range of 250 to 350 C appeared to be NaNO3, NaNO2, and NaOH. Sketches of the two active heat exchange concepts selected for test are given.

  6. A classification system of intraocular lens dislocation sites under operating microscopy, and the surgical techniques and outcomes of exchange surgery.

    Science.gov (United States)

    Hayashi, Ken; Ogawa, Soichiro; Manabe, Shin-Ichi; Hirata, Akira; Yoshimura, Koichi

    2016-03-01

    The aim of this study was to examine the recent status of intraocular lens (IOL) dislocation according to a classification system based on vertical dislocation position, as well as the surgical techniques and outcomes of IOL exchange surgery. The medical records of 230 eyes from 214 consecutive patients who experienced IOL dislocation and underwent exchange surgery between 2006 and 2014 were reviewed. Vertical dislocation sites observed preoperatively under operating microscopy were examined, along with the surgical techniques and outcomes of IOL exchange. Dislocation sites included (1) the anterior chamber (12.2 %), (2) pseudophakodonesis (19.1 %), (3) the anterior vitreous cavity (47.4 %), (4) trap door-like dislocation (dangling in the peripheral vitreous cavity; 16.1 %), and (5) the retinal surface (5.2 %). The IOL retained in the anterior segment was moved onto the iris by pulling it up through the limbal side ports with an anterior vitrectomy (67.8 %), or by pushing it up from the pars plana with an anterior vitrectomy (26.5 %), while the IOL dropped on the retina was lifting it up from the retina after pars plana vitrectomy (5.7 %). Mean uncorrected and distance-corrected visual acuity significantly improved postoperatively (p system, approximately 95 % of dislocated IOLs were retained in the anterior segment, and these IOLs were exchanged using an anterior approach through limbal incisions with an anterior vitrectomy. Visual acuity improved significantly, and serious complications were uncommon, probably because the IOL exchange techniques were standardized and simplified without pars plana vitrectomy.

  7. Thermal and water management of low temperature Proton Exchange Membrane Fuel Cell in fork-lift truck power system

    International Nuclear Information System (INIS)

    Hosseinzadeh, Elham; Rokni, Masoud; Rabbani, Abid; Mortensen, Henrik Hilleke

    2013-01-01

    Highlights: ► Developing a general zero dimensional Proton Exchange Membrane Fuel Cell (PEMFC) model for a forklift. ► System performance with different cooling fluids. ► Water and thermal management of fuel cell system. ► Effect of inlet temperature, outlet temperature and temperature gradient on system performance. - Abstract: A general zero-dimensional Proton Exchange Membrane Fuel Cell (PEMFC) model has been developed for forklift truck application. The balance of plant (BOP) comprises of a compressor, an air humidifier, a set of heat exchangers and a recirculation pump. Water and thermal management of the fuel cell stack and BOP has been investigated in this study. The results show that humidification of the inlet air is of great importance. By decreasing the relative humidity of inlet air from 95% to 25%, the voltage can drop by 29%. In addition, elevated stack temperature can lead to a higher average cell voltage when membrane is fully hydrated otherwise it causes a drastic voltage drop in the stack. Furthermore, by substituting liquid water with water–ethylene glycol mixture of 50%, the mass flow of coolant increases by about 32–33% in the inner loop and 60–65% in the outer loop for all ranges of current. The system can then be started up at about −25 °C with negligible change in the efficiency

  8. Explicitly-correlated ring-coupled-cluster-doubles theory: Including exchange for computations on closed-shell systems

    Energy Technology Data Exchange (ETDEWEB)

    Hehn, Anna-Sophia; Holzer, Christof; Klopper, Wim, E-mail: klopper@kit.edu

    2016-11-10

    Highlights: • Ring-coupled-cluster-doubles approach now implemented with exchange terms. • Ring-coupled-cluster-doubles approach now implemented with F12 functions. • Szabo–Ostlund scheme (SO2) implemented for use in SAPT. • Fast convergence to the limit of a complete basis. • Implementation in the TURBOMOLE program system. - Abstract: Random-phase-approximation (RPA) methods have proven to be powerful tools in electronic-structure theory, being non-empirical, computationally efficient and broadly applicable to a variety of molecular systems including small-gap systems, transition-metal compounds and dispersion-dominated complexes. Applications are however hindered due to the slow basis-set convergence of the electron-correlation energy with the one-electron basis. As a remedy, we present approximate explicitly-correlated RPA approaches based on the ring-coupled-cluster-doubles formulation including exchange contributions. Test calculations demonstrate that the basis-set convergence of correlation energies is drastically accelerated through the explicitly-correlated approach, reaching 99% of the basis-set limit with triple-zeta basis sets. When implemented in close analogy to early work by Szabo and Ostlund [36], the new explicitly-correlated ring-coupled-cluster-doubles approach including exchange has the perspective to become a valuable tool in the framework of symmetry-adapted perturbation theory (SAPT) for the computation of dispersion energies of molecular complexes of weakly interacting closed-shell systems.

  9. Vacuum system design and tritium inventory for the charge exchange diagnostic on the Tokamak Fusion Test Reactor

    International Nuclear Information System (INIS)

    Medley, S.S.

    1986-01-01

    The application of charge exchange analyzers for the measurement of ion temperature in fusion plasma experiments requires a direct connection between the diagnostic and plasma-discharge vacuum chambers. Differential pumping of the gas load from the diagnostic stripping cell operated at > or approx. = 10 -3 Torr is required to maintain the analyzer chamber at a pressure of -6 Torr. The migration of gases between the diagnostic and plasma vacuum chambers must be minimized. In particular, introduction of the analyzer stripping cell gas into the plasma chamber having a base pressure of -8 Torr must be suppressed. The charge exchange diagnostic for the Tokamak Fusion Test Reactor (TFTR) is comprised of two analyzer systems designed to contain a total of 18 independent mass/energy analyzers and one diagnostic neutral beam rated at 80 keV, 15 A. The associated arrays of multiple, interconnected vacuum systems were analyzed using the Vacuum System Transient Simulator (Vsts) computer program which models the transient transport of multigas species through complex networks of ducts, valves, traps, vacuum pumps, and other related vacuum system components. In addition to providing improved design performance at reduced costs, the analysis yields estimates for the exchange of tritium from the torus to the diagnostic components and of the diagnostic working gases to the torus

  10. Double and super-exchange model in one-dimensional systems

    International Nuclear Information System (INIS)

    Vallejo, E.; Navarro, O.; Avignon, M.

    2010-01-01

    We present an analytical and numerical study of the competition between double and super-exchange interactions in a one-dimensional model. For low super-exchange interaction energy we find phase separation between ferromagnetic and anti-ferromagnetic phases. When the super-exchange interaction energy gets larger, the conduction electrons are self-trapped within separate small magnetic polarons. These magnetic polarons contain a single electron inside two or three sites depending on the conduction electron density and form a Wigner crystallization. A new phase separation is found between these small polarons and the anti-ferromagnetic phase. Spin-glass behavior is obtained consistent with experimental results of the nickelate one-dimensional compound Y 2-x Ca x BaNiO 5 .

  11. EU enlargement and new member countries' involvement in the exchange rates system

    Directory of Open Access Journals (Sweden)

    Vlatka Bilas

    2005-08-01

    Full Text Available For each country, joining the union is a unique process, considering advantages and disadvantages which a country can thus obtain. In order to fulfill conditions for the EU accession, transition countries must achieve different convergence criteria. Expansion of the EU brings along many challenges including coordination of policies and conducting a common monetary policy. After joining the EU new members are expected to have a minimum of two years of participation in the Exchange Rate Mechanism 2 before accepting euro. ERM2 can be a flexible and efficient framework for the determination of a appropriate level of irrevocable exchange rate fixing according to euro, as well as for achieving macroeconomic stability. Even though, considering demands for complete abolition of capital controls and high capital mobility, fixed exchange rate with fluctuation margins of ±15% is to become sensitive to the capital movements and speculative attacks.

  12. Optimal design of the first stage of the plate-fin heat exchanger for the EAST cryogenic system

    Science.gov (United States)

    Qingfeng, JIANG; Zhigang, ZHU; Qiyong, ZHANG; Ming, ZHUANG; Xiaofei, LU

    2018-03-01

    The size of the heat exchanger is an important factor determining the dimensions of the cold box in helium cryogenic systems. In this paper, a counter-flow multi-stream plate-fin heat exchanger is optimized by means of a spatial interpolation method coupled with a hybrid genetic algorithm. Compared with empirical correlations, this spatial interpolation algorithm based on a kriging model can be adopted to more precisely predict the Colburn heat transfer factors and Fanning friction factors of offset-strip fins. Moreover, strict computational fluid dynamics simulations can be carried out to predict the heat transfer and friction performance in the absence of reliable experimental data. Within the constraints of heat exchange requirements, maximum allowable pressure drop, existing manufacturing techniques and structural strength, a mathematical model of an optimized design with discrete and continuous variables based on a hybrid genetic algorithm is established in order to minimize the volume. The results show that for the first-stage heat exchanger in the EAST refrigerator, the structural size could be decreased from the original 2.200 × 0.600 × 0.627 (m3) to the optimized 1.854 × 0.420 × 0.340 (m3), with a large reduction in volume. The current work demonstrates that the proposed method could be a useful tool to achieve optimization in an actual engineering project during the practical design process.

  13. Organic iodine removal from simulated dissolver off-gas systems utilizing silver-exchanged mordenite

    International Nuclear Information System (INIS)

    Jubin, R.T.

    1981-01-01

    The removal of methyl iodide by adsorption onto silver mordenite was studied using a simulated off-gas from the fuel dissolution step of a nuclear fuel reprocessing plant. The adsorption of methyl iodide on silver mordenite was examined for the effect of NO/sub x/, humidity, iodine concentration, filter temperature, silver loadings and filter pretreatment. The highest iodine loading achieved in these tests was 142 mg CH 3 I per g of substrate on fully exchanged zeolite, approximately the same as elemental iodine loadings. A filter using fully exchanged silver mordenite operating at 200 0 C obtained higher iodine loadings than a similar filter operating at 150 0 C. Pretreatment of the sorbent bed with hydrogen rather than dry air, at a temperature of 200 0 C, also improved the loading. Variations in the methyl iodide concentration had minimal effects on the overall loading. Filters exposed to moist air streams attained higher loadings than those in contact with dry air. Partially exchanged silver mordenite achieved higher silver utilizations than the fully exchanged material. The partially exchanged mordenite also achieved higher loadings at 200 0 C than at 250 0 C. The iodine loaded onto these beds was not stripped at 500 0 C by either 4.5% hydrogen or 100% hydrogen; however, the iodine could be removed by air at 500 0 C, and the bed could be reloaded. A study of the regeneration characteristics of fully exchanged silver mordenite indicates limited adsorbent capacity after complete removal of the iodine with 4.5% hydrogen in the regeneration gas stream at 500 0 C. The loss of adsorbent capacity is much higher for silver mordenite regenerated in a stainless steel filter housing than in a glass filter housing

  14. Exchange credit risk: Measurement and implications on the stability of partially dollarized financial systems

    Directory of Open Access Journals (Sweden)

    Ernesto Mordecki

    2013-06-01

    Full Text Available Some emergent economies present a high financial dollarization in loans and deposits, generating a specific risk in the banking activity. We quantify this exchange credit risk as the price of an option equivalent to this loan, and discuss the financial stability implications due to the (implicit issuance of these options. The exchange rate is modeled through a Levy process. The depth of the market depends on the type of the currencies involved. Whenever possible, we depart from option prices to calibrate a model, like in the EUR/USD market. But if the market is not liquid, as the USD/UYU market, we provide alternative pricing methodologies.

  15. Thermotechnical comparison of possible operation variants for air conditioning system of mine air with high pressure heat exchanger and hydrodistributor

    OpenAIRE

    Korsun, F. O.

    2015-01-01

    Problem. There are vast losses of cold that take place during the transition of cold to deep horizons of shafts by the mine air conditioning system (MASC) with high pressure heat exchanger. Cold is transferred by the recuperative way. Vast losses of cold mean vast losses of electricity to in order to supply it. Any enterprise requires the reduction of electricity consumption. This article gives proposals on how to replace HPHE into hydrodistributor which will considerably reduce cold losses. ...

  16. The generalisation effects of picture exchange communication system (pecs) training for children with autism and language delay

    OpenAIRE

    Yoon, Jung ae

    2017-01-01

    The Picture Exchange Communication System (PECS) has been widely used in intervention programs to develop functional communication for children who have no or little vocal communication. Studies have shown that PECS training is effective in developing communication and social interaction (Carr & Felce, 2006; Ganz, Simpson, & Corbin-Newsome, 2007) for children with autism. However, most research on the effectiveness of PECS has been limited in several ways. Firstly, few studies have evaluated ...

  17. Remittances and Reputations in Hawala Money-Transfer Systems: Self-Enforcing Exchange on an International Scale

    OpenAIRE

    Skarbek, Emily

    2008-01-01

    Migrant worker remittances often take place outside the scope of government enforcement. Through an examination of the informal remittance transfer system of hawala, this paper argues that self-enforcing exchange mechanisms can support high volume trade in the absence of formal contract enforcement. Hawala networks employ ex post reputation mechanisms between agents and ex ante signaling to uphold obligations under conditions of contract uncertainty.

  18. Verifier-based three-party authentication schemes using extended chaotic maps for data exchange in telecare medicine information systems.

    Science.gov (United States)

    Lee, Tian-Fu

    2014-12-01

    Telecare medicine information systems provide a communicating platform for accessing remote medical resources through public networks, and help health care workers and medical personnel to rapidly making correct clinical decisions and treatments. An authentication scheme for data exchange in telecare medicine information systems enables legal users in hospitals and medical institutes to establish a secure channel and exchange electronic medical records or electronic health records securely and efficiently. This investigation develops an efficient and secure verified-based three-party authentication scheme by using extended chaotic maps for data exchange in telecare medicine information systems. The proposed scheme does not require server's public keys and avoids time-consuming modular exponential computations and scalar multiplications on elliptic curve used in previous related approaches. Additionally, the proposed scheme is proven secure in the random oracle model, and realizes the lower bounds of messages and rounds in communications. Compared to related verified-based approaches, the proposed scheme not only possesses higher security, but also has lower computational cost and fewer transmissions. Copyright © 2014 Elsevier Ireland Ltd. All rights reserved.

  19. Ecological Unequal Exchange: International Trade and Uneven Utilization of Environmental Space in the World System

    Science.gov (United States)

    Rice, James

    2007-01-01

    We evaluate the argument that international trade influences disproportionate cross-national utilization of global renewable natural resources. Such uneven dynamics are relevant to the consideration of inequitable appropriation of environmental space in particular and processes of ecological unequal exchange more generally. Using OLS regression…

  20. Multiply Controlled Verbal Operants: An Analysis and Extension to the Picture Exchange Communication System

    Science.gov (United States)

    Bondy, A.; Tincani, M.; Frost, L.

    2004-01-01

    This paper presents Skinner's (1957) analysis of verbal behavior as a framework for understanding language acquisition in children with autism. We describe Skinner's analysis of pure and impure verbal operants and illustrate how this analysis may be applied to the design of communication training programs. The picture exchange communication system…