Evolving interpretable structure - Activity relationship models. 2. Using multiobjective optimization to derive multiple models

Journal of Chemical Information and Modeling

Volumn 48, Issue 8, 2008, Pages 1558-1570

  Birchall, Kristián ^a   Gillet, Valerie J ^a   Harper, Gavin ^b   Pickett, Stephen D ^b  

^a UNIVERSITY OF SHEFFIELD   (United Kingdom)

^b GLAXOSMITHKLINE   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

EVOLUTIONARY ALGORITHMS; ITERATIVE METHODS; MULTIOBJECTIVE OPTIMIZATION;

HIGH THROUGHPUT SCREENING; MACHINE LEARNING METHODS; MULTI OBJECTIVE EVOLUTIONARY ALGORITHMS; MULTIPLE STRUCTURES; RECALL AND PRECISION; STRUCTURE ACTIVITY; STRUCTURE ACTIVITY RELATIONSHIPS; VIRTUAL SCREENING;

LEARNING SYSTEMS;

SEROTONIN 1 RECEPTOR;

ALGORITHM; ARTICLE; BIOLOGICAL MODEL; CHEMICAL STRUCTURE; DRUG POTENTIATION; HUMAN; METABOLISM; STRUCTURE ACTIVITY RELATION;

ALGORITHMS; HUMANS; MODELS, BIOLOGICAL; MOLECULAR STRUCTURE; RECEPTORS, SEROTONIN, 5-HT1; STRUCTURE-ACTIVITY RELATIONSHIP;

EID: 52049117428     PISSN: 15499596     EISSN: 1549960X     Source Type: Journal    
DOI: 10.1021/ci800051h     Document Type: Article

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