peakPantheR | R Documentation |
peakPantheR detects, integrates and reports pre-defined features in mass spectrometry data files. It enables the real time annotation of multiple compounds in a single file, or the parallel annotation of multiple compounds in multiple files.
The main functions of peakPantheR are
peakPantheR_singleFileSearch
for realtime annotation, and
peakPantheR_parallelAnnotation
for parallel annotation. The
peakPantheRAnnotation
object stores parallel annotation results, while
reporting functions help assess the quality of annotation and update
fitting parameters. Refer to the vignettes for graphical user interface and
command line tutorials.
Maintainer: Arnaud Wolfer adwolfer@gmail.com (ORCID)
Authors:
Goncalo Correia gscorreia89@gmail.com (ORCID)
Other contributors:
Jake Pearce jake.pearce@gmail.com [contributor]
Caroline Sands caz119@hotmail.co.uk [contributor]
Useful links:
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