Welcome to the FourierTransform documentation¶
fouriertransform
is a Python package for analyzing Fourier Transform Ion Cyclotron Resonance Mass Spectrometry (FT-ICR MS) data. fouriertransform
is especially suited for assigning formulae raw MS peaks, categorizing formulae into compound classes according to elemental formula, and creating statistical correlations with environmental parameters.
This package was created by J.D. Hemingway, postdoctoral fellow, Harvard University.
Package Information¶
Authors: | Jordon D. Hemingway (jordon_hemingway@harvard.edu) |
---|---|
Version: | 0.0.8 |
Release: | 25 May 2018 |
License: | GNU GPL v3 (or greater) |
url: | http://github.com/FluvialSeds/fouriertransform |
Bug Reports¶
This software is still in active deveopment. Please report any bugs directly to me.
How to Cite¶
When analyzing data with fouriertransform
to be used in a peer-reviewed
journal, please cite this package as:
- J.D. Hemingway. fouriertransform: open-source tools for FT-ICR MS data analysis, 2017-, http://github.com/FluvialSeds/fouriertransform [online; accessed 2018-06-06]
Additionally, please cite the following peer-reviewed manuscript describing the deveopment of the package and data treatment:
- to be added
License¶
This product is licensed under the GNU GPL license, version 3 or greater.