Lipid Annotation for LC-MS/MS DDA or DIA Data

Lipid annotation in untargeted LC-MS lipidomics based on fragmentation rules. Alcoriza-Balaguer MI, Garcia-Canaveras JC, Lopez A, Conde I, Juan O, Carretero J, Lahoz A (2019) .

LipidMS v3.1

Lipid Annotation for LC-MS/MS DIA and DDA data analysis.

• Improved GUI through shiny app running LipidMSapp().

Citation:

If you use this software in your research, please cite:

• Alcoriza-Balaguer MI., et al. (2019) LipidMS: An R Package for Lipid Annotation in Untargeted Liquid Chromatography-Data Independent Acquisition-Mass Spectrometry Lipidomics. Anal Chem, 2019, 91(1), 836-845. doi:10.1021/acs.analchem.8b03409.
• LipidMS 3.0: an R-package and a web-based tool for LC-MS/MS data processing and lipid annotation. Bioinformatics, 2022. doi.org/10.1093/bioinformatics/btac581

References:

• Peak-picking algorithm has been imported from enviPick R-package (Martin Loos) (https://github.com/blosloos/enviPick)