Name Mode Size
R 040000
inst 040000
man 040000
tests 040000
vignettes 040000
.BBSoptions 100644 0 kb
.gitignore 100644 0 kb
.travis.yml 100644 1 kb
DESCRIPTION 100644 2 kb
NAMESPACE 100755 3 kb 100644 1 kb
# RMassBank Workflow to process tandem MS files and build MassBank records. Functions include automated extraction of tandem MS spectra, formula assignment to tandem MS fragments, recalibration of tandem MS spectra with assigned fragments, spectrum cleanup, automated retrieval of compound information from Internet databases, and export to MassBank records. Authors: Michael Stravs, Emma Schymanski, Steffen Neumann, Erik Mueller, with contributions from Tobias Schulze Maintainer: RMassBank at Eawag <massbank at> Citation (from within R, enter `citation("RMassBank")`): Stravs MA, Schymanski EL, Singer H and Hollender J (2013). “Automatic Recalibration and Processing of Tandem Mass Spectra using Formula Annotation.” Journal of Mass Spectrometry, 48(1), pp. 188. # Continuous integration The RMassBank project master branch is subjected to CI using travis: [![Build Status](](