MetNC: Predicting Metabolites in vivo for Natural Compounds

MetNC: Predicting Metabolites in vivo for Natural Compounds

Natural compounds (NCs) undergo complicated biotransformation in vivo to produce diverse forms of metabolites dynamically, many of which are of high medicinal value. Predicting the profiles of chemical products may help to narrow down possible candidates, yet current computational methods for predic...

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Bibliographic Details
Main Authors: Zikun Chen, Deyu Yan, Mou Zhang, Wenhao Han, Yuan Wang, Shudi Xu, Kailin Tang, Jian Gao, Zhiwei Cao
Format: Article
Language:English
Published: Frontiers Media S.A. 2022-05-01
Series:Frontiers in Chemistry
Subjects:
natural compounds
in vivo biotransformation
metabolites
prediction
reaction rules
Online Access:https://www.frontiersin.org/articles/10.3389/fchem.2022.881975/full

Internet

https://www.frontiersin.org/articles/10.3389/fchem.2022.881975/full

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