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CliqueMS: a computational tool for annotating in-source metabolite ions from LC-MS untargeted metabolomics data based on a coelution similarity network

MOTIVATION: The analysis of biological samples in untargeted metabolomic studies using LC-MS yields tens of thousands of ion signals. Annotating these features is of the utmost importance for answering questions as fundamental as, e.g. how many metabolites are there in a given sample. RESULTS: Here,...

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Detalles Bibliográficos
Autores principales: Senan, Oriol, Aguilar-Mogas, Antoni, Navarro, Miriam, Capellades, Jordi, Noon, Luke, Burks, Deborah, Yanes, Oscar, Guimerà, Roger, Sales-Pardo, Marta
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Oxford University Press 2019
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6792096/
https://www.ncbi.nlm.nih.gov/pubmed/30903689
http://dx.doi.org/10.1093/bioinformatics/btz207