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MAW: the reproducible Metabolome Annotation Workflow for untargeted tandem mass spectrometry

Mapping the chemical space of compounds to chemical structures remains a challenge in metabolomics. Despite the advancements in untargeted liquid chromatography-mass spectrometry (LC–MS) to achieve a high-throughput profile of metabolites from complex biological resources, only a small fraction of t...

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Detalles Bibliográficos
Autores principales: Zulfiqar, Mahnoor, Gadelha, Luiz, Steinbeck, Christoph, Sorokina, Maria, Peters, Kristian
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Springer International Publishing 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9985203/
https://www.ncbi.nlm.nih.gov/pubmed/36871033
http://dx.doi.org/10.1186/s13321-023-00695-y