Effect of electrostatic polarization and bridging water on CDK2-ligand binding affinities calculated using a highly efficient interaction entropy method.
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Trypsin-Ligand binding affinities calculated using an effective interaction entropy method under polarized force field.A theoretical insight into selectivity of inhibitors toward two domains of bromodomain-containing protein 4 using molecular dynamics simulations.Computational revelation of binding mechanisms of inhibitors to endocellular protein tyrosine phosphatase 1B using molecular dynamics simulations.Recent Developments and Applications of the MMPBSA Method.Mutation L1196M-induced conformational changes and the drug resistant mechanism of anaplastic lymphoma kinase studied by free energy perturbation and umbrella sampling.Exploring the Reasons for Decrease in Binding Affinity of HIV-2 Against HIV-1 Protease Complex Using Interaction Entropy Under Polarized Force FieldMolecular Dynamics Exploration of Selectivity of Dual Inhibitors 5M7, 65X, and 65Z toward Fatty Acid Binding Proteins 4 and 5
P2860
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P2860
Effect of electrostatic polarization and bridging water on CDK2-ligand binding affinities calculated using a highly efficient interaction entropy method.
description
2017 nî lūn-bûn
@nan
2017年の論文
@ja
2017年学术文章
@wuu
2017年学术文章
@zh
2017年学术文章
@zh-cn
2017年学术文章
@zh-hans
2017年学术文章
@zh-my
2017年学术文章
@zh-sg
2017年學術文章
@yue
2017年學術文章
@zh-hant
name
Effect of electrostatic polari ...... nt interaction entropy method.
@en
Effect of electrostatic polari ...... nt interaction entropy method.
@nl
type
label
Effect of electrostatic polari ...... nt interaction entropy method.
@en
Effect of electrostatic polari ...... nt interaction entropy method.
@nl
prefLabel
Effect of electrostatic polari ...... nt interaction entropy method.
@en
Effect of electrostatic polari ...... nt interaction entropy method.
@nl
P2093
P2860
P356
P1476
Effect of electrostatic polari ...... ent interaction entropy method
@en
P2093
Lizhi Wang
Qinggang Zhang
Xianwei Wang
P2860
P304
10140-10152
P356
10.1039/C7CP00841D
P407
P577
2017-04-01T00:00:00Z