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Good practices and recommendations for using and benchmarking computational metabolomics metabolite annotation tools

BACKGROUND: Untargeted metabolomics approaches based on mass spectrometry obtain comprehensive profiles of complex biological samples. However, on average only 10% of the molecules can be annotated. This low annotation rate hampers biochemical interpretation and effective comparison of metabolomics...

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Detalles Bibliográficos
Autores principales: de Jonge, Niek F., Mildau, Kevin, Meijer, David, Louwen, Joris J. R., Bueschl, Christoph, Huber, Florian, van der Hooft, Justin J. J.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Springer US 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9722809/
https://www.ncbi.nlm.nih.gov/pubmed/36469190
http://dx.doi.org/10.1007/s11306-022-01963-y