Changelog

All notable changes to GlyComboCLI will be documented here.

[Unreleased]

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Initial release of GlyComboCLI
Support for native, permethylated, and peracetylated derivatisations
Support for Free, Reduced, InstantPC, Rapifluor-MS, 2-AA, 2-AB, Procainamide, Girard's reagent P, and custom reducing ends
mzML input support for Bruker, Thermo, Agilent, Waters, and Sciex instruments
Plain text, mzML and Galaxy mass list input support
Positive and negative mode adducts: MH+, MNa+, MNH4+, MK+, MH-, MFA-, MAA-, MTFA-, Neutral
Modified sialic acid support: lactonised, ethyl esterified, dimethylamidated, and ammonia amidated NeuAc and NeuGc
Phosphate, sulfate, dHexNAc, and acetylation modifications
Up to five user-defined custom monosaccharides
Custom reducing end support
Custom adduct support
Skyline-compatible CSV output for mzML input
Parameter log file output
Off-by-one isotope correction flag
ppm and Da mass error modes