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- Van Mooy, Benjamin A. S., et al. Show all 4 Authors
- Analytical chemistry 2016 v.88 no.14 pp. 7154-7162
- Phaeodactylum tricornutum; automation; biomarkers; chloroplasts; computer software; data collection; databases; high performance liquid chromatography; hydrogen peroxide; mass spectrometry; oxidation; oxidative stress; oxylipins; screening; triacylglycerols
- ... Discovery and identification of molecular biomarkers in large LC/MS data sets requires significant automation without loss of accuracy in the compound screening and annotation process. Here, we describe a lipidomics workflow and open-source software package for high-throughput annotation and putative identification of lipid, oxidized lipid, and oxylipin biomarkers in high-mass-accuracy HPLC-MS dat ...