Comparative molecular surface analysis: A novel tool for drug design and molecular diversity studies

Molecular Diversity

Volumn 7, Issue 1, 2003, Pages 45-59

  Polanski, Jaroslaw ^a   Gieleciak, Rafal ^a  

^a UNIVERSITY OF SILESIA   (Poland)

Author keywords

3 D QSAR; CoMSA; Molecular diversity; PCA; PLS; Self organizing neural networks

Indexed keywords

COMBINATORIAL CHEMISTRY; COMPARATIVE MOLECULAR FIELD ANALYSIS; DATA ANALYSIS; DRUG DESIGN; INFORMATION PROCESSING; MOLECULAR DYNAMICS; MOLECULAR MODEL; PRIORITY JOURNAL; REVIEW; SURFACE PROPERTY;

ANTI-HIV AGENTS; COMBINATORIAL CHEMISTRY TECHNIQUES; DOPAMINE ANTAGONISTS; DRUG DESIGN; ELECTROSTATICS; HIV INTEGRASE; MODELS, MOLECULAR; MOLECULAR CONFORMATION; NEURAL NETWORKS (COMPUTER); QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIP; SURFACE PROPERTIES;

EID: 0347087255     PISSN: 13811991     EISSN: None     Source Type: Journal    
DOI: 10.1023/B:MODI.0000006536.02970.f0     Document Type: Review

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