deisotoper: Detection of Isotope Pattern of a Mass Spectrometric Measurement

Provides a low-level interface for a deisotoper container implemented in the 'Java' programming language and means of S3 helper functions for plotting and debugging isotopes of mass spectrometric data. The deisotoper algorithm detects and aggregates peaks which belong to the same isotopic cluster of a given mass spectrum.

Version: 0.0.3
Depends: R (≥ 3.0), rJava (≥ 0.9)
Suggests: DiagrammeR, lattice, roxygen2, protViz (≥ 0.2.45), shiny, testthat, knitr, rmarkdown
Published: 2017-12-19
Author: Christian Panse ORCID iD [cre, aut], Lucas Schmidt ORCID iD [ctb, aut], Witold E. Wolski ORCID iD [ctb, aut]
Maintainer: Christian Panse <cp at>
BugReports: deisotoper.R
License: GPL-3
NeedsCompilation: yes
SystemRequirements: Java JDK 1.8 or higher, GNU make
Materials: README
CRAN checks: deisotoper results


Reference manual: deisotoper.pdf
Vignettes: Hands-on: Using the deisotoper package
Package source: deisotoper_0.0.3.tar.gz
Windows binaries: r-devel:, r-release:, r-oldrel:
OS X binaries: r-release: deisotoper_0.0.3.tgz, r-oldrel: deisotoper_0.0.3.tgz
Old sources: deisotoper archive


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