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Improving MetFrag with statistical learning of fragment annotations

BACKGROUND: Molecule identification is a crucial step in metabolomics and environmental sciences. Besides in silico fragmentation, as performed by MetFrag, also machine learning and statistical methods evolved, showing an improvement in molecule annotation based on MS/MS data. In this work we presen...

詳細記述

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書誌詳細
出版年:BMC Bioinformatics
主要な著者: Ruttkies, Christoph, Neumann, Steffen, Posch, Stefan
フォーマット: Artigo
言語:Inglês
出版事項: BioMed Central 2019
主題:
オンライン・アクセス:https://ncbi.nlm.nih.gov/pmc/articles/PMC6612146/
https://ncbi.nlm.nih.gov/pubmed/31277571
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1186/s12859-019-2954-7
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