# MassElTOF
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MassElTOF is a python package for the analysis of mass spectrometry data.
It was created as a custom analysis package for one of my PhD projects and is
still a work in progress.
A distinctive feature is its capability to calulate masses and theoretical fragmentation
spectra of arbitrarily isotopically labeled peptides.
The (WIP) documentation can be found [here](https://kantundpeterpan.gitlab.io/masseltof).
This packages was used for the bigger of the analyses in the following publication:
**Atze, H.; Rusconi, F.; Arthur, M.**
Heavy Isotope Labeling and Mass Spectrometry Reveal Unexpected Remodeling of Bacterial Cell Wall Expansion in Response to Drugs. bioRxiv 2021. https://doi.org/10.1101/2021.08.06.454924.