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Volumn 24, Issue 2, 2005, Pages 240-253
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4D-QSAR models of HOE/BAY-793 analogues as HIV-1 protease inhibitors
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Author keywords
4D QSAR; C2 symmetric diol; HIV protease
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Indexed keywords
COMPUTATIONAL CHEMISTRY;
CONFORMATIONS;
GENETIC ALGORITHMS;
GEOMETRY;
LEAST SQUARES APPROXIMATIONS;
MOLECULAR DYNAMICS;
MOLECULAR GRAPHICS;
4D-QSAR;
AMINO-ACIDS;
C2-SYMMETRIC DIOL;
HIV-1 PROTEASE;
HIV-1 PROTEASE INHIBITORS;
HIV-PROTEASE;
HOMODIMERS;
QSAR MODEL;
QUANTITATIVE STRUCTURE ACTIVITY RELATIONSHIP;
SYMMETRICS;
CELL CULTURE;
AMPRENAVIR;
ANTIVIRUS AGENT;
ASPARTIC ACID;
BAY 793;
CARBONYL DERIVATIVE;
DIAMINODIOL INHIBITOR;
DIMER;
GLYCINE;
HOE 793;
HYDROXYL GROUP;
INDINAVIR;
LOPINAVIR;
MONOMER;
NELFINAVIR;
PROTEINASE;
PROTEINASE INHIBITOR;
RITONAVIR;
SAQUINAVIR;
UNCLASSIFIED DRUG;
AMINO ACID SEQUENCE;
ARTICLE;
BINDING KINETICS;
BINDING SITE;
CONFORMATIONAL TRANSITION;
CRYSTAL STRUCTURE;
DRUG CONFORMATION;
DRUG POTENCY;
DRUG RECEPTOR BINDING;
ENZYME ACTIVE SITE;
ENZYME ANALYSIS;
ENZYME INHIBITION;
ENZYME STRUCTURE;
EVALUATION;
GENETIC ALGORITHM;
GEOMETRY;
HUMAN IMMUNODEFICIENCY VIRUS 1;
HYDROGEN BOND;
IC 50;
IN VITRO STUDY;
MATHEMATICAL MODEL;
MOLECULAR DYNAMICS;
MOLECULAR INTERACTION;
MOLECULAR MODEL;
NONHUMAN;
PHARMACOPHORE;
PRIORITY JOURNAL;
QUANTITATIVE STRUCTURE ACTIVITY RELATION;
REGRESSION ANALYSIS;
SIMULATION;
STRUCTURE ANALYSIS;
TECHNIQUE;
TEMPERATURE DEPENDENCE;
HUMAN IMMUNODEFICIENCY VIRUS 1;
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EID: 17144374002
PISSN: 1611020X
EISSN: None
Source Type: Journal
DOI: 10.1002/qsar.200430893 Document Type: Article |
Times cited : (18)
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References (27)
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