AutoGrow: A novel algorithm for protein inhibitor design

Chemical Biology and Drug Design

Volumn 73, Issue 2, 2009, Pages 168-178

  Durrant, Jacob D ^a   Amaro, Rommie E ^a   McCammon, J Andrew ^a  

^a UNIVERSITY OF CALIFORNIA   (United States)

Author keywords

AutoGrow; Docking; Evolutionary algorithm; Rational drug design

Indexed keywords

ADENOSINE TRIPHOSPHATE; AMINOIMIDAZOLE 4 CARBOXAMIDE RIBONUCLEOTIDE; OSELTAMIVIR; PHOSPHORIBOSYLAMINOIMIDAZOLECARBOXAMIDE FORMYLTRANSFERASE; PROTEIN INHIBITOR; SIALIDASE; UNCLASSIFIED DRUG;

ALGORITHM; ARTICLE; BINDING AFFINITY; BINDING SITE; COMPUTER AIDED DESIGN; CRYSTAL STRUCTURE; CRYSTALLOGRAPHY; DRUG DESIGN; DRUG PROTEIN BINDING; DRUG STRUCTURE; HYDROGEN BOND; LIGAND BINDING; NONHUMAN; PRIORITY JOURNAL;

ALGORITHMS; COMPUTER SIMULATION; COMPUTER-AIDED DESIGN; CRYSTALLOGRAPHY, X-RAY; DRUG DESIGN; PROTEINS; SMALL MOLECULE LIBRARIES; SOFTWARE; STRUCTURE-ACTIVITY RELATIONSHIP;

EID: 58849145223     PISSN: 17470277     EISSN: None     Source Type: Journal    
DOI: 10.1111/j.1747-0285.2008.00761.x     Document Type: Article

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