Rank-ordering protein-ligand binding affinity by a quantum mechanics/molecular mechanics/Poisson-Boltzmann-surface area model.
作者信息
Wang Mingliang, Wong Chung F
机构信息
Department of Chemistry and Biochemistry, University of Missouri-Saint Louis, One University Boulevard, Saint Louis, Missouri 63121, USA.
出版信息
J Chem Phys. 2007 Jan 14;126(2):026101. doi: 10.1063/1.2423029.
PMID:17228977
Abstract
摘要
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