blosloos/enviPat: Isotope Pattern, Profile and Centroid Calculation for Mass Spectrometry
Version 2.3

Fast and very memory-efficient calculation of isotope patterns, subsequent convolution to theoretical envelopes (profiles) plus valley detection and centroidization or intensoid calculation. Batch processing, resolution interpolation, wrapper, adduct calculations and molecular formula parsing.

Getting started

Package details

AuthorMartin Loos, Christian Gerber
MaintainerMartin Loos <[email protected]>
LicenseGPL-2
Version2.3
URL http://www.envipat.eawag.ch/ http://pubs.acs.org/doi/abs/10.1021/acs.analchem.5b00941
Package repositoryView on GitHub
Installation Install the latest version of this package by entering the following in R:
install.packages("devtools")
library(devtools)
install_github("blosloos/enviPat")
blosloos/enviPat documentation built on Jan. 9, 2018, 3:25 p.m.