Peak annotation and verification engine (PAVE) for untargeted LC-MS metabolomics

Untargeted metabolomics can detect more than 10,000 peaks in a single LC-MS run. The correspondence between these peaks and metabolites, however, remains unclear. Here we introduce a Peak Annotation and Verification Engine (PAVE) for annotating untargeted microbial metabolomics data. The workflow in...

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Publicat a:Anal Chem
Autors principals: Wang, Lin, Xing, Xi, Chen, Li, Yang, Lifeng, Su, Xiaoyang, Rabitz, Herschel, Lu, Wenyun, Rabinowitz, Joshua D.
Format: Artigo
Idioma:Inglês
Publicat: 2019
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Article
Accés en línia:https://ncbi.nlm.nih.gov/pmc/articles/PMC6501219/
https://ncbi.nlm.nih.gov/pubmed/30586294
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.analchem.8b03132
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