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Generalized tree structure to annotate untargeted metabolomics and stable isotope tracing data

In untargeted metabolomics, multiple ions are often measured for each original metabolite, including isotopic forms and in-source modifications, such as adducts and fragments. Without prior knowledge of the chemical identity or formula, computational organization and interpretation of these ions is...

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Detalles Bibliográficos
Autores principales: Li, Shuzhao, Zheng, Shujian
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Cold Spring Harbor Laboratory 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9881955/
https://www.ncbi.nlm.nih.gov/pubmed/36711587
http://dx.doi.org/10.1101/2023.01.04.522722