A check on rational drug design: Molecular simulation of the allosteric inhibition of HIV-1 reverse transcriptase

Medicinal Research Reviews

Volumn 17, Issue 3, 1997, Pages 235-276

  Mager, Peter P ^a  

^a UNIVERSITY OF LEIPZIG   (Germany)

Author keywords

allosteric binding centers; drug design; HIV 1 reverse transcriptase (RT); MASCA model; molecular dynamics; molecular simulation; nonsubstrate inhibitors of RT

Indexed keywords

ANTI HUMAN IMMUNODEFICIENCY VIRUS AGENT; NEVIRAPINE; RNA DIRECTED DNA POLYMERASE; RNA DIRECTED DNA POLYMERASE INHIBITOR; SOLVENT; VIRUS ENZYME;

ALLOSTERISM; ANTIVIRAL ACTIVITY; DRUG BINDING; DRUG CONFORMATION; DRUG DESIGN; ENZYME CONFORMATION; ENZYME INHIBITION; HUMAN IMMUNODEFICIENCY VIRUS 1; HYDROGEN BOND; MOLECULAR DYNAMICS; NONHUMAN; PHYSICAL CHEMISTRY; QUANTITATIVE STRUCTURE ACTIVITY RELATION; REVIEW; SITE DIRECTED MUTAGENESIS; TEMPERATURE;

AMINO ACID SEQUENCE; BINDING SITES; CHEMISTRY, PHYSICAL; COMPUTER SIMULATION; DRUG DESIGN; HIV-1 REVERSE TRANSCRIPTASE; MODELS, CHEMICAL; MOLECULAR SEQUENCE DATA; PROTEIN CONFORMATION; PROTEIN FOLDING; REVERSE TRANSCRIPTASE INHIBITORS;

EID: 0030887575     PISSN: 01986325     EISSN: None     Source Type: Journal    
DOI: 10.1002/(SICI)1098-1128(199705)17:3<235::AID-MED2>3.0.CO;2-Z     Document Type: Review

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