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Volumn 30, Issue 5, 2011, Pages 443-458

Development and comparison of herg blocker classifiers: Assessment on different datasets yields markedly different results

(3) Marchese Robinson, Richard L a Glen, Robert C a Mitchell, John B O b

a UNIVERSITY OF CAMBRIDGE (United Kingdom)

b UNIVERSITY OF ST ANDREWS (United Kingdom)

Author keywords

Classification; HERG; Toxicology; Virtual screening; Winnow

Indexed keywords

SUPPORT VECTOR MACHINES;

BINARY CLASSIFICATION; CARDIOTOXICITY; CLASSIFICATION MODELS; DESCRIPTORS; HERG; PHARMACEUTICAL INDUSTRY; PROSPECTIVES; TOXICOLOGY; VIRTUAL SCREENING; WINNOW;

CLASSIFICATION (OF INFORMATION);

POTASSIUM CHANNEL BLOCKING AGENT; POTASSIUM CHANNEL HERG;

ARTICLE; CARDIOTOXICITY; CORRELATION COEFFICIENT; DRUG CLASSIFICATION; DRUG INDUSTRY; MOLECULAR MODEL; PREDICTION; PRIORITY JOURNAL; RANDOM FOREST; SUPPORT VECTOR MACHINE; SYSTEMATIC ERROR; VALIDATION PROCESS; VIRTUAL REALITY;

EID: 79958775318 PISSN: 18681743 EISSN: 18681751 Source Type: Journal
DOI: 10.1002/minf.201000159 Document Type: Article

Times cited : (40)

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