This project folder showcases how chromatographic data can be currently handled using chromatopy
. Besides the raw data, located in the data/
folder, two Jupyter Notebooks are within this example project. In shimadzu-example.ipynb
8 chromatograms are read in at once and peaks of interest are extracted. In single-chromatogram.ipynb
a single chromatograms is read in from a CSV file, the chromatogram is fitted and peaks are annotated.
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FAIRChemistry/chromatography-example
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