Predicting molecular interactions in silico: I. A guide to pharmacophore identification and its applications to drug design

Current Medicinal Chemistry

Volumn 11, Issue 1, 2004, Pages 71-90

  Dror, Oranit ^a   Shulman Peleg, Alexandra ^a   Nussinov, Ruth ^a,b   Wolfson, Haim J ^a  

^a TEL AVIV UNIVERSITY   (Israel)

^b SAIC FREDERICK INC   (United States)

Author keywords

Computer aided drug design; De Novo design; Docking; Lead generation; Pharmacophore fingerprints; Pharmacophore mapping; Pharmacophore modeling; Pharmacophore searching; Receptor based pharmacophore; Virtual screening

Indexed keywords

DRUG; LIGAND; RECEPTOR PROTEIN;

ALGORITHM; BINDING AFFINITY; COMPUTER AIDED DESIGN; COMPUTER MODEL; DRUG CONFORMATION; DRUG DESIGN; DRUG SCREENING; DRUG STRUCTURE; GENETIC ANALYSIS; MOLECULAR INTERACTION; PHARMACOPHORE; PREDICTION; PROTEIN STRUCTURE; QUANTITATIVE STRUCTURE ACTIVITY RELATION; RECEPTOR BINDING; REVIEW; STRUCTURE ANALYSIS;

ALGORITHMS; COMPUTER-AIDED DESIGN; DATABASES, FACTUAL; DRUG DESIGN; DRUG INTERACTIONS; LIGANDS; MOLECULAR CONFORMATION; PROTEIN BINDING; QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIP; RECEPTORS, DRUG;

EID: 0347755449     PISSN: 09298673     EISSN: None     Source Type: Journal    
DOI: 10.2174/0929867043456287     Document Type: Review

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