Browsing Faculty of Mathematics and Natural Sciences by Subject "metabolism prediction"
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GLORY: Generator of the structures of likely cytochrome P450 metabolites based on predicted sites of metabolism
(Peer reviewed; Journal article, 2019-06-12)Computational prediction of xenobiotic metabolism can provide valuable information to guide the development of drugs, cosmetics, agrochemicals, and other chemical entities. We have previously developed FAME 2, an effective ...