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This package\nfacilitates such type of analyses by providing high level\nquality control plots, deconvoluting and evaluating spectra,\nand performing a multitude of tests in an automatic fashion.\nThe main idea is to use changing intensity ratios of ion pairs\nfrom a peak list, i.e. generated with 'xcms' as candidates and\nevaluate those against base peak chromatograms and spectra\ninformation within the raw measurement data automatically. The\nfunctionality is described in Hoffmann et al. 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