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Prediction of metabolic reactions based on atomic and molecular properties of small-molecule compounds

Motivation: Our knowledge of the metabolites in cells and their reactions is far from complete as revealed by metabolomic measurements that detect many more small molecules than are documented in metabolic databases. Here, we develop an approach for predicting the reactivity of small-molecule metabo...

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Detalhes bibliográficos
Main Authors: Mu, Fangping, Unkefer, Clifford J., Unkefer, Pat J., Hlavacek, William S.
Formato: Artigo
Idioma:Inglês
Publicado em: Oxford University Press 2011
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC3102224/
https://ncbi.nlm.nih.gov/pubmed/21478194
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1093/bioinformatics/btr177
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