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ALLocator: An Interactive Web Platform for the Analysis of Metabolomic LC-ESI-MS Datasets, Enabling Semi-Automated, User-Revised Compound Annotation and Mass Isotopomer Ratio Analysis

Adduct formation, fragmentation events and matrix effects impose special challenges to the identification and quantitation of metabolites in LC-ESI-MS datasets. An important step in compound identification is the deconvolution of mass signals. During this processing step, peaks representing adducts,...

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Detalles Bibliográficos
Autores principales: Kessler, Nikolas, Walter, Frederik, Persicke, Marcus, Albaum, Stefan P., Kalinowski, Jörn, Goesmann, Alexander, Niehaus, Karsten, Nattkemper, Tim W.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Public Library of Science 2014
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4245236/
https://www.ncbi.nlm.nih.gov/pubmed/25426929
http://dx.doi.org/10.1371/journal.pone.0113909