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Tools for working with GCMS files.

Project Description

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)

Release history Release notifications

This version
History Node

0.2.0

History Node

0.1.1

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Filename, size & hash SHA256 hash help File type Python version Upload date
gcmstools-0.2.0.tar.gz (13.4 kB) Copy SHA256 hash SHA256 Source None May 13, 2015

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