From hits to leads: Challenges for the next phase of machine learning in medicinal chemistry

Molecular Informatics

Volumn 30, Issue 9, 2011, Pages 759-763

  Schneider, Gisbert ^a  

^a ETH ZURICH   (Switzerland)

Author keywords

Computational chemistry; Drug design; Machine learning; Medicinal chemistry; Virtual screening

Indexed keywords

ARTIFICIAL INTELLIGENCE; E-LEARNING; LEARNING SYSTEMS;

DRUG DESIGN; MACHINE-LEARNING; MEDICINAL CHEMISTRY; VIRTUAL SCREENING;

COMPUTATIONAL CHEMISTRY;

ANALYTICAL ERROR; ARTICLE; CLINICAL CHEMISTRY; DATA ANALYSIS; HIGH THROUGHPUT SCREENING; MACHINE LEARNING; MATHEMATICAL MODEL; PRIORITY JOURNAL; VALIDATION PROCESS;

EID: 80052897144     PISSN: 18681743     EISSN: 18681751     Source Type: Journal    
DOI: 10.1002/minf.201100070     Document Type: Article

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