cheminfo / mass-tools

Various projects dealing with molecular formula
https://cheminfo.github.io/mass-tools/
MIT License
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Report EICs characteristics #29

Open jdesport opened 3 years ago

jdesport commented 3 years ago

Users may visualize extracted ion chromatograms. It would be useful to have the characteristics of the EIC automatically reported in a table: retention time at peak maximum, FWHM, area. This is especially useful for analysis where a chromatogram peak picking is not possible (ex: SEC or IMS data). (A determination of FWHM from a gaussian fit would be even better.)