Computer-aided drug design: The next 20 years

Journal of Computer-Aided Molecular Design

Volumn 21, Issue 10-11, 2007, Pages 591-601

  Drie, John H ^a  

^a John H Van Drie Research LLC   (United States)

Author keywords

ADME models; CoMFA; Pharmacophores; Protein protein interactions; Thermodynamics

Indexed keywords

PROTEINS;

ADME MODEL; AMERICAN CHEMICAL SOCIETY; CHICAGO; COMFA; COMPUTER AIDED DRUG DESIGN; PHARMACOPHORES; PROTEIN-PROTEIN INTERACTIONS;

THERMODYNAMICS;

CAPTOPRIL; ENALAPRIL; GLITAZONE DERIVATIVE; INDINAVIR; PHOSPHATASE; PROTON PUMP INHIBITOR; RITONAVIR; SAQUINAVIR;

ARTICLE; COMPARATIVE MOLECULAR FIELD ANALYSIS; COMPARATIVE MOLECULAR SIMILARITY INDICES ANALYSIS; COMPUTER AIDED DESIGN; COMPUTER INTERFACE; COMPUTER MODEL; COMPUTER PROGRAM; DATA BASE; DRUG DESIGN; DRUG EFFICACY; DRUG INDUCED DISEASE; DRUG INDUSTRY; DRUG SCREENING; DRUG TARGETING; ECONOMIC EVALUATION; HIGH THROUGHPUT SCREENING; HUMAN GENOME; INVESTMENT; MATHEMATICAL MODEL; MOLECULAR DYNAMICS; MOLECULAR MECHANICS; PHARMACOPHORE; PRIORITY JOURNAL; PROTEIN CONFORMATION; PROTEIN PROTEIN INTERACTION; QUANTITATIVE STRUCTURE ACTIVITY RELATION; QUANTUM CHEMISTRY; SUPPORT VECTOR MACHINE; THERMODYNAMICS; THREE DIMENSIONAL IMAGING; TRANSCRIPTION REGULATION; VIRTUAL REALITY; X RAY CRYSTALLOGRAPHY;

EID: 36949019801     PISSN: 0920654X     EISSN: 15734951     Source Type: Journal    
DOI: 10.1007/s10822-007-9142-y     Document Type: Article

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