Evaluation of quantitative structure-activity relationship modeling strategies: Local and global models

Journal of Chemical Information and Modeling

Volumn 50, Issue 4, 2010, Pages 677-689

  Helgee, Ernst Ahlberg ^a   Carlsson, Lars ^a   Boyer, Scott ^a   Norinder, Ulf ^b  

^a ASTRAZENECA R AND D   (Sweden)

^b ASTRAZENECA R AND D   (Sweden)

Author keywords

[No Author keywords available]

Indexed keywords

DECISION TREES; LEAST SQUARES APPROXIMATIONS; RISK ASSESSMENT; SUPPORT VECTOR MACHINES;

COMPUTATIONAL COSTS; GLOBAL MODELING; GLOBAL MODELS; LOCAL MODEL; LOCAL STRATEGIES; PARTIAL LEAST SQUARE (PLS); QSAR MODEL; QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIP MODELING;

COMPUTATIONAL CHEMISTRY;

ARTICLE; BIOLOGY; CHEMICAL STRUCTURE; COMPUTER SIMULATION; HUMAN; METHODOLOGY; QUANTITATIVE STRUCTURE ACTIVITY RELATION; RISK ASSESSMENT; TIME;

COMPUTATIONAL BIOLOGY; COMPUTER SIMULATION; HUMANS; MODELS, MOLECULAR; QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIP; RISK ASSESSMENT; TIME FACTORS;

EID: 77952003134     PISSN: 15499596     EISSN: 1549960X     Source Type: Journal    
DOI: 10.1021/ci900471e     Document Type: Article

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