Autonomous METLIN-Guided In-source Fragment Annotation for Untargeted Metabolomics

Volume: 91, Issue: 5, Pages: 3246 - 3253
Published: Jan 25, 2019
Abstract
Computational metabolite annotation in untargeted profiling aims at uncovering neutral molecular masses of underlying metabolites and assign those with putative identities. Existing annotation strategies rely on the observation and annotation of adducts to determine metabolite neutral masses. However, a significant fraction of features usually detected in untargeted experiments remains unannotated, which limits our ability to determine neutral...
Paper Details
Title
Autonomous METLIN-Guided In-source Fragment Annotation for Untargeted Metabolomics
Published Date
Jan 25, 2019
Volume
91
Issue
5
Pages
3246 - 3253
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