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LipidFrag: Improving reliability of in silico fragmentation of lipids and application to the Caenorhabditis elegans lipidome

Lipid identification is a major bottleneck in high-throughput lipidomics studies. However, tools for the analysis of lipid tandem MS spectra are rather limited. While the comparison against spectra in reference libraries is one of the preferred methods, these libraries are far from being complete. I...

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Bibliographic Details
Published in:PLoS One
Main Authors: Witting, Michael, Ruttkies, Christoph, Neumann, Steffen, Schmitt-Kopplin, Philippe
Format: Artigo
Language:Inglês
Published: Public Library of Science 2017
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Online Access:https://ncbi.nlm.nih.gov/pmc/articles/PMC5344313/
https://ncbi.nlm.nih.gov/pubmed/28278196
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1371/journal.pone.0172311
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