Zobrazeno 1 - 10 of 19 pro vyhledávání: '"Z R, Wasserman"'
1
A molecular dynamics investigation of the elastomeric restoring force in elastin
Autor: Z. R. Wasserman, F. R. Salemme
Publikováno v: Biopolymers. 29:1613-1631
A repetitive polypentapeptide organized as a connected chain of beta-bends is believed to be an important structural element of elastin, the major elastomer in biological systems. Molecular dynamics simulations were carried out on hydrated polymers o
Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::aa26707323f55c86738be712fd6c20dc
https://doi.org/10.1002/bip.360291211
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2
Design and synthesis of a series of (2R)-N(4)-hydroxy-2-(3-hydroxybenzyl)-N(1)- [(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]butanediamide derivatives as potent, selective, and orally bioavailable aggrecanase inhibitors
Autor: W, Yao, Z R, Wasserman, M, Chao, G, Reddy, E, Shi, R Q, Liu, M B, Covington, E C, Arner, M A, Pratta, M, Tortorella, R L, Magolda, R, Newton, M, Qian, M D, Ribadeneira, D, Christ, R R, Wexler, C P, Decicco
Publikováno v: Journal of medicinal chemistry. 44(21)
A pharmacophore model of the P1' site, specific for aggrecanase, was defined using the specificity studies of the matrix metalloproteinases and the similar biological activity of aggrecanase and MMP-8. Incorporation of the side chain of a tyrosine re
Externí odkaz: https://explore.openaire.eu/search/publication?articleId=pmid________::66b60bcb0ff1f67244f659e6c7b37881
https://pubmed.ncbi.nlm.nih.gov/11585439
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3
Fitting an inhibitor into the active site of thermolysin: a molecular dynamics case study
Autor: Z R, Wasserman, C N, Hodge
Publikováno v: Proteins. 24(2)
We used molecular dynamics computer simulation to "fly" a small flexible ligand, L-leucine hydroxamic acid, into the active site of thermolysin. The potential, which imposed no constraints between protein and ligand, produced conformations close to t
Externí odkaz: https://explore.openaire.eu/search/publication?articleId=pmid________::91f5a16795f721a11f5db669db04b9dc
https://pubmed.ncbi.nlm.nih.gov/8820489
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9
The spherical Compton profile of neopentane and the carbon–carbon single bond of diamond
Autor: P. Eisenberger, Thomas A. Weber, W. A. Reed, Lawrence C. Snyder, X. J. Pinder, Z. R. Wasserman
Publikováno v: The Journal of Chemical Physics. 67:143-146
The spherically averaged Compton profile of neopentane is measured and also calculated from an ab initio SCF–MO wave function. The measured Compton profile of diamond, corresponding to a carbon–carbon bond (C–C), is compared is empirical C–C
Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_________::ef4dd02cbeed77bff6baccaab40c016d
https://doi.org/10.1063/1.434558
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10
Brownian Dynamics Study of Polymer Conformational Transitions±
Autor: Z. R. Wasserman, Thomas A. Weber, Eugene Helfand
Publikováno v: Macromolecules. 13:526-533
Conformational transitions of a macromolecule have been studied by computer simulation of the Brownian dynamics of a polymer chain. An activation energy equal to about one barrier height has been found. However, there is a great deal of cooperativity
Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_________::e43353ac2eee650655af7552044ebed2
https://doi.org/10.1021/ma60075a011
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