Solvent models for protein-ligand binding: Comparison of implicit solvent Poisson and Surface Generalized Born models with explicit solvent simulations

Journal of Computational Chemistry

Volumn 22, Issue 6, 2001, Pages 591-607

  Zhang, Linda Yu ^a   Gallicchio, Emilio ^a   Friesner, Richard A ^b   Levy, Ronald M ^a  

^a RUTGERS UNIVERSITY   (United States)

^b Och Spine at New York Presbyterian Hospitals   (United States)

Author keywords

Free energy perturbation; Generalized Born model; Implicit solvent models; Protein electrostatics; Protein ligand binding

Indexed keywords

EID: 20644436466     PISSN: 01928651     EISSN: None     Source Type: Journal    
DOI: 10.1002/jcc.1031     Document Type: Article

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