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Published in 2022 at "Analytical chemistry"
DOI: 10.1021/acs.analchem.1c04758
Abstract: Choosing appropriate data processing parameters is critical in processing liquid chromatography-mass spectrometry (LC-MS)-based untargeted metabolomics data. The conventional design of experiments (DOE) approach is time-consuming and provides no intuitive explanation why the selected parameters generate…
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Keywords:
paramounter;
feature extraction;
universal parameters;
metabolomics data ... See more keywords