A dual fingerprint-based metric for the design of focused compound libraries and analogs

Journal of Molecular Modeling

Volumn 7, Issue 5, 2001, Pages 125-131

  Xue, Ling ^a   Godden, Jeffrey W ^a   Stahura, Florence L ^a   Bajorath, Jürgen ^a,b  

^a ALBANY MOLECULAR RESEARCH INC   (United States)

^b UNIVERSITY OF WASHINGTON   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

5 METHYL 7,8 DIHYDROXYISOQUINOLINE 3 CARBOXYLIC ACID; ADENOSINE TRIPHOSPHATE; AMINOGENISTEIN; DAMNACANTHAL; ENZYME INHIBITOR; ISOQUINOLINE DERIVATIVE; PROTEIN KINASE; PROTEIN KINASE INHIBITOR; RPR 108518A; TYRPHOSTIN; UNCLASSIFIED DRUG;

ALGORITHM; ARTICLE; BIODIVERSITY; CONTROLLED STUDY; DRUG ACTIVITY; DRUG BINDING SITE; DRUG DESIGN; DRUG STRUCTURE; DRUG TARGETING; ENZYME ACTIVITY; ENZYME INHIBITION; ENZYME SPECIFICITY; ENZYME SUBSTRATE; MATHEMATICAL COMPUTING; MOLECULAR LIBRARY; PRINCIPAL COMPONENT ANALYSIS; PRIORITY JOURNAL; PROBABILITY;

EID: 0035789519     PISSN: 16102940     EISSN: None     Source Type: Journal    
DOI: 10.1007/S008940100019     Document Type: Article

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