Package: InterpretMSSpectrum
Type: Package
Title: Interpreting High Resolution GC-APCI-MS Spectra
Version: 0.83
Date: 2016-09-05
Authors@R: person("Jan", "Lisec", role = c("aut", "cre"), email = "jan.lisec@charite.de")
Author: Jan Lisec [aut, cre]
Description: A deconvoluted mass spectrum (mass*intensity pairs) from Tri-Methyl-Silyl-derivatized GC-APCI-MS (Gas Chromatography-Atmospheric Pressure Chemical Ionization-Mass Spectrometry) data can be read, evaluated and plotted in an informative fashion. The main purpose is to identify the causal metabolite or more precisely the sum formula of the molecular peak within the spectrum.
URL: http://dx.doi.org/10.1021/acs.analchem.6b02743
License: GPL-3
Depends: R(>= 2.10.0)
Imports: Rdisop, enviPat, plyr
RoxygenNote: 5.0.1
NeedsCompilation: no
Packaged: 2016-09-06 07:11:44 UTC; lisecj
Maintainer: Jan Lisec <jan.lisec@charite.de>
Repository: CRAN
Date/Publication: 2016-09-06 10:04:39
