Cytochrome P450 site of metabolism prediction from 2D topological fingerprints using GPU accelerated probabilistic classifiers

Journal of Cheminformatics

Volumn 6, Issue 1, 2014, Pages

  Tyzack, Jonathan D ^a   Mussa, Hamse Y ^a   Williamson, Mark J ^a   Kirchmair, Johannes ^b   Glen, Robert C ^a  

^a UNIVERSITY OF CAMBRIDGE   (United Kingdom)

^b ETH ZURICH   (Switzerland)

Author keywords

2D; Classification; CUDA; Cytochrome P450; GPU; Metabolism; Probabilistic

Indexed keywords

EID: 84902143032     PISSN: None     EISSN: 17582946     Source Type: Journal    
DOI: 10.1186/1758-2946-6-29     Document Type: Article

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