Rapid flexible docking using a stochastic rotamer library of ligands

Journal of Chemical Information and Modeling

Volumn 50, Issue 9, 2010, Pages 1623-1632

  Ding, Feng ^a   Yin, Shuangye ^a   Dokholyan, Nikolay V ^a  

^a UNIVERSITY OF NORTH CAROLINA SCHOOL OF MEDICINE   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ENZYMES; STOCHASTIC SYSTEMS;

COMPUTATIONAL DOCKINGS; CONFORMATIONAL CHANGE; CYCLIN-DEPENDENT KINASE; DOCKING SIMULATIONS; HIV REVERSE TRANSCRIPTASE; PREDICTION ACCURACY; RECEPTOR FLEXIBILITY; VASCULAR ENDOTHELIAL GROWTH FACTOR RECEPTOR;

LIGANDS;

LIGAND;

ALGORITHM; ARTICLE; DRUG DEVELOPMENT; STATISTICS;

ALGORITHMS; DRUG DISCOVERY; LIGANDS; STOCHASTIC PROCESSES;

EID: 77957237749     PISSN: 15499596     EISSN: 1549960X     Source Type: Journal    
DOI: 10.1021/ci100218t     Document Type: Article

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