Potentials of mean force between ionizable amino acid side chains in water.
作者： Artëm Masunov , Themis Lazaridis
DOI: 10.1021/JA025521W
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摘要: Potentials of mean force (PMF) between all possible ionizable amino acid side chain pairs in various protonation states were calculated using explicit solvent molecular dynamics simulations with um...
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