Entropic and enthalpic contributions to stereospecific ligand binding from enhanced sampling methods.
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Pyranose dehydrogenase ligand promiscuity: a generalized approach to simulate monosaccharide solvation, binding, and product formation.Combining molecular dynamics simulation and ligand-receptor contacts analysis as a new approach for pharmacophore modeling: beta-secretase 1 and check point kinase 1 as case studies.Specific Residue Interactions Regulate the Binding of Dengue Antigens to Broadly Neutralizing EDE Antibodies
P2860
Entropic and enthalpic contributions to stereospecific ligand binding from enhanced sampling methods.
description
2014 nî lūn-bûn
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2014年の論文
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name
Entropic and enthalpic contrib ...... rom enhanced sampling methods.
@en
type
label
Entropic and enthalpic contrib ...... rom enhanced sampling methods.
@en
prefLabel
Entropic and enthalpic contrib ...... rom enhanced sampling methods.
@en
P2860
P356
P1476
Entropic and enthalpic contrib ...... rom enhanced sampling methods.
@en
P2093
Gabor Nagy
Jose Antonio Garate
P2860
P304
P356
10.1021/CI4006657
P577
2014-01-09T00:00:00Z