Package: erah
Type: Package
Title: Automated Spectral Deconvolution, Alignment, and Metabolite
        Identification in GC/MS-Based Untargeted Metabolomics
Version: 1.1.0
Date: 2018-07-10
Author: Xavier Domingo-Almenara [aut, cre, cph], Sara Samino [aut], Maria Vinaixa [aut], Alexandre Perera [aut, ths], Jesus Brezmes [aut, ths], Oscar Yanes [aut, ths]
Depends: R (>= 2.10), Rcpp
Imports: ncdf4, nnls, igraph, signal, quantreg, XML, methods
Suggests: R.rsp, mzR
Maintainer: Xavier Domingo-Almenara <xdomingo@scripps.edu>
Description: Automated compound deconvolution, alignment across samples, and identification of metabolites by spectral library matching in Gas Chromatography - Mass spectrometry (GC-MS) untargeted metabolomics. Outputs a table with compound names, matching scores and the integrated area of the compound for each sample. Package implementation is described in Domingo-Almenara et al. (2016) <doi:10.1021/acs.analchem.6b02927>.
License: GPL (>= 2)
URL: http://metabolomicsplatform.com/
Repository: CRAN
LazyData: yes
NeedsCompilation: yes
VignetteBuilder: R.rsp
Packaged: 2018-07-10 21:45:39 UTC; xavidomingo
Date/Publication: 2018-07-11 05:00:07 UTC
