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GLORY: Generator of the Structures of Likely Cytochrome P450 Metabolites Based on Predicted Sites of Metabolism

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 tool for predicting sites of metabolism (SoMs). In this work, we focus on the...

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Vydáno v:Front Chem
Hlavní autoři: de Bruyn Kops, Christina, Stork, Conrad, Šícho, Martin, Kochev, Nikolay, Svozil, Daniel, Jeliazkova, Nina, Kirchmair, Johannes
Médium: Artigo
Jazyk:Inglês
Vydáno: Frontiers Media S.A. 2019
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On-line přístup:https://ncbi.nlm.nih.gov/pmc/articles/PMC6582643/
https://ncbi.nlm.nih.gov/pubmed/31249827
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3389/fchem.2019.00402
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