Metabolic reaction network-based recursive metabolite annotation for untargeted metabolomics

Large-scale metabolite annotation is a challenge in liquid chromatogram-mass spectrometry (LC-MS)-based untargeted metabolomics. Here, we develop a metabolic reaction network (MRN)-based recursive algorithm (MetDNA) that expands metabolite annotations without the need for a comprehensive standard sp...

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Gepubliceerd in:Nat Commun
Hoofdauteurs: Shen, Xiaotao, Wang, Ruohong, Xiong, Xin, Yin, Yandong, Cai, Yuping, Ma, Zaijun, Liu, Nan, Zhu, Zheng-Jiang
Formaat: Artigo
Taal:Inglês
Gepubliceerd in: Nature Publishing Group UK 2019
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Article
Online toegang:https://ncbi.nlm.nih.gov/pmc/articles/PMC6447530/
https://ncbi.nlm.nih.gov/pubmed/30944337
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1038/s41467-019-09550-x
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