Description:

gcmstools 0.2.0

This library serves two roles: 1) to provide a class to read standard GCMS
data files, and 2) to fit the data using various fitting routines. The usage
and installation of this package is outlined in the online user guide,
which is also available as a pdf.
Currently, this package implements the following:
File Imports

AIA (CDF) files

Fitting Routines

Non-negative least squares (nnls) fitting

Isotopic Analysis

Analyze the distribution of isotopes (for isotopic labeling experiments)

License

For personal and professional use. You cannot resell or redistribute these repositories in their original state.

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