Protein ligand docking based on empirical method for binding affinity estimation

Journal of Computer-Aided Molecular Design

Volumn 15, Issue 5, 2001, Pages 429-446

  Tao, Peng ^a   Lai, Luhua ^a  

^a Peking University   (China)

Author keywords

Affinity; Binding; Docking; Molecular recognition; Protein ligand interactions; Score

Indexed keywords

BINDING ENERGY; COMPLEXATION; LIGANDS; MOLECULES; PROTEINS;

AFFINITY; BINDING; BINDING AFFINITIES; DOCKING; EMPIRICAL METHOD; PROTEIN-LIGAND COMPLEXES; PROTEIN-LIGAND DOCKING; PROTEIN-LIGAND INTERACTIONS; QUALITY ASSESSMENT; SCORE;

EQUILIBRIUM CONSTANTS;

DRUG; LIGAND; METAL; PROTEIN; WATER;

ACCURACY; ARTICLE; BINDING AFFINITY; CALCULATION; CHEMICAL STRUCTURE; COMPLEX FORMATION; COMPUTER PROGRAM; CONTROLLED STUDY; DISSOCIATION CONSTANT; DRUG DESIGN; DRUG STRUCTURE; EQUILIBRIUM CONSTANT; LIGAND BINDING; METHODOLOGY; PRIORITY JOURNAL; PROTEIN BINDING; QUALITY CONTROL; RELIABILITY; WATER STRUCTURE;

EID: 0035011980     PISSN: 0920654X     EISSN: None     Source Type: Journal    
DOI: 10.1023/A:1011188704521     Document Type: Article

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