Original paper
BioTransformer: a comprehensive computational tool for small molecule metabolism prediction and metabolite identification
Abstract
A number of computational tools for metabolism prediction have been developed over the last 20 years to predict the structures of small molecules undergoing biological transformation or environmental degradation. These tools were largely developed to facilitate absorption, distribution, metabolism, excretion, and toxicity (ADMET) studies, although there is now a growing interest in using such tools to facilitate metabolomics and exposomics...
Paper Details
Title
BioTransformer: a comprehensive computational tool for small molecule metabolism prediction and metabolite identification
Published Date
Jan 5, 2019
Journal
Volume
11
Issue
1
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Notes
History