Quantifying the entropy of binding for water molecules in protein cavities by computing correlations
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Estimation of Solvation Entropy and Enthalpy via Analysis of Water Oxygen-Hydrogen CorrelationsDefying the activity-stability trade-off in enzymes: taking advantage of entropy to enhance activity and thermostability.Spatial Decomposition of Translational Water-Water Correlation Entropy in Binding Pockets.Studying the role of cooperative hydration in stabilizing folded protein states.The impact of binding thermodynamics on medicinal chemistry optimizations.On the accuracy of one- and two-particle solvation entropies.Stay Wet, Stay Stable? How Internal Water Helps the Stability of Thermophilic Proteins.The Binding Mode of the Sonic Hedgehog Inhibitor Robotnikinin, a Combined Docking and QM/MM MD Study.Protein conformational flexibility modulates kinetics and thermodynamics of drug binding.The Role of Interfacial Water in Protein-Ligand Binding: Insights from the Indirect Solvent Mediated Potential of Mean Force.Enhancing Structure Prediction and Design of Soluble and Membrane Proteins with Explicit Solvent-Protein Interactions.Relationship between Solvation Thermodynamics from IST and DFT Perspectives.Solvent effects on ligand binding to a serine protease.Free Energy, Enthalpy and Entropy from Implicit Solvent End-Point Simulations.On the positional and orientational order of water and methanol around indole: a study on the microscopic origin of solubility.Dynamics and Thermodynamics of Transthyretin Association from Molecular Dynamics Simulations.
P2860
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P2860
Quantifying the entropy of binding for water molecules in protein cavities by computing correlations
description
2015 nî lūn-bûn
@nan
2015 թուականի Փետրուարին հրատարակուած գիտական յօդուած
@hyw
2015 թվականի փետրվարին հրատարակված գիտական հոդված
@hy
2015年の論文
@ja
2015年論文
@yue
2015年論文
@zh-hant
2015年論文
@zh-hk
2015年論文
@zh-mo
2015年論文
@zh-tw
2015年论文
@wuu
name
Quantifying the entropy of bin ...... ties by computing correlations
@ast
Quantifying the entropy of bin ...... ties by computing correlations
@en
Quantifying the entropy of bin ...... ties by computing correlations
@nl
type
label
Quantifying the entropy of bin ...... ties by computing correlations
@ast
Quantifying the entropy of bin ...... ties by computing correlations
@en
Quantifying the entropy of bin ...... ties by computing correlations
@nl
prefLabel
Quantifying the entropy of bin ...... ties by computing correlations
@ast
Quantifying the entropy of bin ...... ties by computing correlations
@en
Quantifying the entropy of bin ...... ties by computing correlations
@nl
P2860
P3181
P1433
P1476
Quantifying the entropy of bin ...... ties by computing correlations
@en
P2093
David J Huggins
P2860
P304
P3181
P356
10.1016/J.BPJ.2014.12.035
P407
P577
2015-02-01T00:00:00Z