Search Results - "BENCSURA, A"

Assessing structure, function and druggability of major inhibitory neurotransmitter gamma-aminobutyrate symporter subtypes by Kardos, J, Palló, A, Bencsura, A, Simon, A

“…Ambient level of gamma -aminobutyric acid (GABA), the major inhibitory neurotransmitter of the brain is mediated by neuronal and glial GABA transporters…”
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Molecular dynamics study of active-site interactions with tetracoordinate transients in acetylcholinesterase and its mutants by Enyedy, I J, Kovach, I M, Bencsura, A

“…The role of active-site residues in the dealkylation reaction in the P(S)C(S) diastereomer of 2-(3,3-dimethylbutyl)methylphosphonofluoridate (soman)-inhibited…”
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Characterization of binding mode of imatinib to human α1-acid glycoprotein by Fitos, I., Simon, Á., Zsila, F., Mády, G., Bencsura, Á., Varga, Z., Őrfi, L., Kéri, G., Visy, J.

“…Imatinib (IMT) is a selective tyrosine kinase inhibitor, used in the treatment of chronic myeloid leukemia and gastrointestinal stromal tumors. Its strong…”
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Enantioselective and Reversible Inhibition of Trypsin and .alpha.-Chymotrypsin by Phosphonate Esters by Zhao, Qinjian, Kovach, Ildiko M, Bencsura, Akos, Papathanassiu, Adonia

“…Trypsin is inactivated by the levorotatory enantiomers (most likely PS) of 4-nitrophenyl 4-H-, 4-CH3-,4-OCH3-, and 4-Cl-phenacyl methylphosphonates (PMNs) with…”
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Unimolecular Decomposition of the FCO Radical by Knyazev, Vadim D, Bencsura, Ákos, Slagle, Irene R

“…The kinetics of the unimolecular decomposition of the FCO radical has been studied experimentally in a heated tubular flow reactor coupled to a photoionization…”
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Weak collision effects in the reaction C2H5 ⇄ C2H4 + H by FENG, Y, NIIRANEN, J. T, BENCSURA, A, KNYAZEV, V. D, GUTMAN, D, TSANG, W

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Substrate-Na super(+) complex formation: Coupling mechanism for gamma -aminobutyrate symporters by Pallo, A, Simon, A, Bencsura, A, Heja, L, Kardos, J

“…Crystal structures of transmembrane transport proteins belonging to the important families of neurotransmitter-sodium symporters reveal how they transport…”
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Kinetics of the unimolecular decomposition of iso-C3H7 : weak collision effects in helium, argon, and nitrogen by SEAKINS, P. W, ROBERTSON, S. H, PILLING, M. J, SLAGLE, I. R, GMURCZYK, G. W, BENCSURA, A, GUTMAN, D, TSANG, W

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Major human γ-aminobutyrate transporter: In silico prediction of substrate efficacy by Palló, Anna, Bencsura, Ákos, Héja, László, Beke, Tamás, Perczel, András, Kardos, Julianna, Simon, Ágnes

“…The inhibitory γ-aminobutyric acid transporter subtype 1 (GAT1) maintains low resting synaptic GABA level, and is a potential target for antiepileptic drugs…”
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Kinetics and Thermochemistry of the Reaction of 1-Chloroethyl Radical with Molecular Oxygen by Knyazev, Vadim D, Bencsura, Akos, Dubinsky, Ilia A, Gutman, David, Melius, Carl F, Senkan, Selim M

“…The kinetics of the reaction CH[sub 3]CHCl + O[sub 2] [l reversible] CH[sub 3]ChClO[sub 2] [yields] products (1) has been studied at temperatures 296-839 K and…”
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Kinetics of the unimolecular decomposition of isopropyl: weak collision effects in helium, argon, and nitrogen by Seakins, P. W, Robertson, S. H, Pilling, M. J, Slagle, I. R, Gmurczyk, G. W, Bencsura, A, Gutman, D, Tsang, W

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Weak collision effects in the reaction ethyl radical .dblarw. ethene + hydrogen by Feng, Y, Niiranen, J. T, Bencsura, A, Knyazev, V. D, Gutman, D, Tsang, W

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Modeling the cluster formation during infrared and ultraviolet matrix-assisted laser desorption ionization of oligonucleotides in succinic acid matrix with molecular mechanics by Kristyan, Sandor, Bencsura, Akos, Vertes, Akos

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Dynamics of hydrogen bonding and energy transfer in matrix-assisted laser desorption by Bencsura, Akos, Vertes, Akos

“…A molecular dynamics simulation of matrix-assisted laser desorption is presented for host and guest particles with internal structure. The laser-induced phase…”
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Matrix-Guest Energy Transfer in Matrix-assisted Laser Desorption by Bencsura, Akos, Navale, Vivek, Sadeghi, Mehrnoosh, Vertes, Akos

“…Molecular dynamics was used to analyze energy transfer rates between matrix and guest molecules in matrix‐assisted laser desorption allowing for a large number…”
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Origins and Diversity of the Aging Reaction in Phosphonate Adducts of Serine Hydrolase Enzymes: What Characteristics of the Active Site do They Probe? by Bencsura, Akos, Enyedy, Istvan, Kovach, Ildiko M

“…Molecular mechanics and dynamics combined with semiempirical calculations were carried out for purposes of comparison of the active site characteristics of…”
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Probing the Active Site of Acetylcholinesterase by Molecular Dynamics of Its Phosphonate Ester Adducts by Bencsura, Akos, Enyedy, Istvan Y, Kovach, Ildiko M

“…Molecular dynamics (MD) simulations using CHARMM were performed for the solution structures of the pentacoordinate and tetracoordinate PSCS and PRCS adducts of…”
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Kinetics of the Reaction of the CHCl2 Radical with Oxygen Atoms by Stoliarov, Stanislav I, Bencsura, Ákos, Shafir, Eugene, Knyazev, Vadim D, Slagle, Irene R

“…The kinetics of the reaction of CHCl2 radical with O(3P) atoms has been studied in a heatable tubular reactor coupled to a photoionization mass spectrometer…”
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Efficient product clearance through exit channels in substrate hydrolysis by acetylcholinesterase by Kovach, Ildiko M., Qian, Naifeng, Bencsura, Akos

“…The channels connecting the active site of acetylcholinesterase (AChE) to the protein exterior were mapped by computational techniques in order to find…”
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Kinetics of the unimolecular decomposition of iso-C[sub 3]H. Weak collision effects in helium, argon, and nitrogen by Seakins, P.W., Robertson, S.H., Pilling, M.J., Slagle, I.R., Gmurczyk, G.W., Bencsura, A., Gutman, D., Tsang, W.

“…Rate constants for the unimolecular decomposition of iso-C[sub 3]H[sub 7] have been determined by laser flash photolysis coupled with photoionization mass…”
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