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James Dillon edited this page Aug 26, 2016 · 22 revisions

Chromatography Toolbox (v0.1.51) provides command line data processing methods for chromatography and mass spectrometry data in MATLAB.

###Table of Contents

  1. Initialize
  2. Import
  3. Baseline
  4. Smooth
  5. Integrate
  6. Visualize

###Initialize Initialize the Chromatography class to use any of the following methods: import, centroid, baseline, smooth, integrate, visualize.

obj = Chromatography

###Import
Import raw data into the MATLAB workspace with the import method. Supported formats include: Agilent (.D), Thermo (.RAW), and netCDF (.CDF).

data = obj.import(filetype, 'OptionName', optionvalue)

###Baseline
Perform baseline correction with the baseline method.

data = obj.baseline(data, 'OptionName', optionvalue)

###Smooth
Smooth raw data with the smooth method.

data = obj.smooth(data, 'OptionName', optionvalue)

###Integrate
Find peaks and determine peak area using the integrate method.

data = obj.integrate(data, 'OptionName', optionvalue)

###Visualize
Plot data and export high quality figures using the visualize method.

fig = obj.visualize(data, 'OptionName', optionvalue)
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