CorrectOverloadedPeaks: Correct Overloaded Peaks from GC-APCI-MS Data

Analyzes and modifies metabolomics raw data (generated using Gas Chromatography-Atmospheric Pressure Chemical Ionization-Mass Spectrometry) to correct overloaded signals, i.e. ion intensities exceeding detector saturation leading to a cut-off peak. Data in 'xcmsRaw' format are accepted as input and 'mzXML' files can be processed alternatively. Overloaded signals are detected automatically and modified using an Gaussian or an Isotopic-Ratio approach. Quality control plots are generated and corrected data are stored within the original 'xcmsRaw' or 'mzXML' respectively to allow further processing.

Package details

AuthorJan Lisec [aut, cre] (<https://orcid.org/0000-0003-1220-2286>)
MaintainerJan Lisec <jan.lisec@bam.de>
LicenseGPL-3
Version1.3.5
URL https://github.com/janlisec/CorrectOverloadedPeaks
Package repositoryView on CRAN
Installation Install the latest version of this package by entering the following in R:
install.packages("CorrectOverloadedPeaks")

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CorrectOverloadedPeaks documentation built on April 3, 2025, 9:31 p.m.