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Bayesian networks for mass spectrometric metabolite identification via molecular fingerprints

MOTIVATION: Metabolites, small molecules that are involved in cellular reactions, provide a direct functional signature of cellular state. Untargeted metabolomics experiments usually rely on tandem mass spectrometry to identify the thousands of compounds in a biological sample. Recently, we presente...

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Bibliographic Details
Published in:Bioinformatics
Main Authors: Ludwig, Marcus, Dührkop, Kai, Böcker, Sebastian
Format: Artigo
Language:Inglês
Published: Oxford University Press 2018
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Online Access:https://ncbi.nlm.nih.gov/pmc/articles/PMC6022630/
https://ncbi.nlm.nih.gov/pubmed/29949965
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1093/bioinformatics/bty245
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