Water-Driven Cavity-Ligand Binding: Comparison of Thermodynamic Signatures from Coarse-Grained and Atomic-Level Simulations.
about
Entropy-enthalpy compensation: role and ramifications in biomolecular ligand recognition and design.Approaches to efficiently estimate solvation and explicit water energetics in ligand binding: the use of WaterMap.Perspective on the Martini model.Perspective: Coarse-grained models for biomolecular systems.Parameterization of a coarse-grained model with short-ranged interactions for modeling fuel cell membranes with controlled water uptake.The impact of resolution upon entropy and information in coarse-grained models.Thermodynamic and structural signatures of water-driven methane-methane attraction in coarse-grained mW water.
P2860
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P2860
Water-Driven Cavity-Ligand Binding: Comparison of Thermodynamic Signatures from Coarse-Grained and Atomic-Level Simulations.
description
2012 nî lūn-bûn
@nan
2012年の論文
@ja
2012年論文
@yue
2012年論文
@zh-hant
2012年論文
@zh-hk
2012年論文
@zh-mo
2012年論文
@zh-tw
2012年论文
@wuu
2012年论文
@zh
2012年论文
@zh-cn
name
Water-Driven Cavity-Ligand Bin ...... and Atomic-Level Simulations.
@en
type
label
Water-Driven Cavity-Ligand Bin ...... and Atomic-Level Simulations.
@en
prefLabel
Water-Driven Cavity-Ligand Bin ...... and Atomic-Level Simulations.
@en
P356
P1476
Water-Driven Cavity-Ligand Bin ...... and Atomic-Level Simulations.
@en
P2093
Riccardo Baron
Valeria Molinero
P304
P356
10.1021/CT300121R
P577
2012-06-14T00:00:00Z