Evaluating docking programs: Keeping the playing field level

Journal of Computer-Aided Molecular Design

Volumn 22, Issue 3-4, 2008, Pages 229-238

  Liebeschuetz, John W ^a  

^a CAMBRIDGE CRYSTALLOGRAPHIC DATA CENTRE   (United Kingdom)

Author keywords

Docking; Enrichment; Factor Xa; GOLD; Protein ligand interaction; Thrombin; Virtual screening

Indexed keywords

BINDING ENERGY; GOLD; PROTEINS;

DOCKING; DOCKING PROGRAMS; ENRICHMENT; FACTOR XA; FIELD LEVEL; GOLD; PLAYING FIELDS; PROTEIN-LIGAND INTERACTIONS; THROMBIN; VIRTUAL SCREENING;

LIGANDS;

ARTICLE; BINDING AFFINITY; BINDING SITE; COMPUTER PREDICTION; COMPUTER PROGRAM; DATA ANALYSIS SOFTWARE; INTERMETHOD COMPARISON; MOLECULAR DOCKING; PRIORITY JOURNAL; PROTEIN BINDING; PROTEIN DATA BANK; PROTEIN STRUCTURE; RECEPTOR BINDING;

EID: 41349102961     PISSN: 0920654X     EISSN: 15734951     Source Type: Journal    
DOI: 10.1007/s10822-008-9169-8     Document Type: Article

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