Neighborhood behavior of in silico structural spaces with respect to in vitro activity spaces - A novel understanding of the molecular similarity principle in the context of multiple receptor binding profiles

Journal of Chemical Information and Computer Sciences

Volumn 43, Issue 2, 2003, Pages 680-690

  Horvath, Dragos ^a   Jeandenans, Catherine ^a  

^a CEREP   (France)

Author keywords

[No Author keywords available]

Indexed keywords

CHEMOINFORMATICS;

DRUG PRODUCTS; INFORMATION ANALYSIS; LEAD COMPOUNDS;

MOLECULAR STRUCTURE;

CELL RECEPTOR;

ALGORITHM; ANIMAL; ARTICLE; CHEMISTRY; FACTUAL DATABASE; HUMAN; METABOLISM; METHODOLOGY; PROTEIN BINDING; STATISTICAL ANALYSIS; STRUCTURE ACTIVITY RELATION;

ALGORITHMS; ANIMALS; CHEMISTRY, PHARMACEUTICAL; DATA INTERPRETATION, STATISTICAL; DATABASES, FACTUAL; HUMANS; MATCHED-PAIR ANALYSIS; PROTEIN BINDING; RECEPTORS, CYTOPLASMIC AND NUCLEAR; STRUCTURE-ACTIVITY RELATIONSHIP;

EID: 0037365125     PISSN: 00952338     EISSN: None     Source Type: Journal    
DOI: 10.1021/ci025634z     Document Type: Conference Paper

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