A hierarchical method for generating low-energy conformers of a protein- ligand complex

Proteins: Structure, Function and Genetics

Volumn 33, Issue 4, 1998, Pages 475-495

  Given, James A ^a   Gilson, Michael K ^a  

^a UNIVERSITY OF MARYLAND BIOTECHNOLOGY INSTITUTE   (United States)

Author keywords

Affinity; Binding; Dielectric; Dihydrofolate reductase; Docking; Dynamics; Generalized Born; HIV protease; Landscape; Methotrexate; Thermolys in

Indexed keywords

ALGORITHM; ARTICLE; BINDING SITE; COMPLEX FORMATION; ENERGY; LIGAND BINDING; MOLECULAR DYNAMICS; PRIORITY JOURNAL; PROTEIN BINDING; PROTEIN CONFORMATION;

ALGORITHMS; BINDING SITES; CRYSTALLOGRAPHY; LIGANDS; MODELS, STATISTICAL; MOLECULAR CONFORMATION; MOLECULAR STRUCTURE; PROTEIN BINDING; PROTEIN CONFORMATION; PROTEIN STRUCTURE, SECONDARY; PROTEINS;

EID: 0032374033     PISSN: 08873585     EISSN: None     Source Type: Journal    
DOI: 10.1002/(SICI)1097-0134(19981201)33:4<475::AID-PROT3>3.0.CO;2-B     Document Type: Article

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