Incorporating protein flexibility in structure-based drug discovery: Using HIV-1 protease as a test case

Journal of the American Chemical Society

Volumn 126, Issue 41, 2004, Pages 13276-13281

  Meagher, Kristin L ^a   Carlson, Heather A ^a  

^a UNIVERSITY OF MICHIGAN   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTATIONAL METHODS; CONFORMATIONS; CRYSTAL STRUCTURE; MATHEMATICAL MODELS; PROTEINS; VIRUSES;

DRUG DESIGN; DRUG DISCOVERY; PROTEIN STRUCTURES;

DRUG PRODUCTS;

PROTEINASE;

ARTICLE; CONFORMATIONAL TRANSITION; CRYSTAL STRUCTURE; DRUG DESIGN; HUMAN IMMUNODEFICIENCY VIRUS 1; LIGAND BINDING; MOLECULAR DYNAMICS; PHARMACOPHORE; PROTEIN CONFORMATION; PROTEIN STRUCTURE;

COMPUTER SIMULATION; DRUG DESIGN; HIV PROTEASE; HIV PROTEASE INHIBITORS; LIGANDS; MODELS, MOLECULAR; PROTEIN CONFORMATION; STRUCTURE-ACTIVITY RELATIONSHIP;

EID: 6344245774     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja0469378     Document Type: Article

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