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Published in 2020 at "Journal of chemometrics"
DOI: 10.1002/cem.3236
Abstract: The peak alignment is a vital preprocessing step before downstream analysis, such as biomarker discovery and pathway analysis, for two-dimensional gas chromatography mass spectrometry (2DGCMS)-based metabolomics data. Due to uncontrollable experimental conditions, e.g., the differences…
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Keywords:
mass spectrometry;
algorithms;
peak alignment;
distance ... See more keywords