Package: erah
Type: Package
Title: Automated Spectral Deconvolution, Alignment, and Metabolite
        Identification in GC/MS-Based Untargeted Metabolomics
Version: 1.1.2
Date: 2021-05-10
Author: Xavier Domingo-Almenara [aut, cre, cph], Jasen P. Finch [ctb], Sara Samino [aut], Maria Vinaixa [aut], Alexandre Perera [aut, ths], Jesus Brezmes [aut, ths], Oscar Yanes [aut, ths]
Depends: Rcpp, R (>= 3.5.0)
Imports: ncdf4, nnls, igraph, signal, quantreg, XML, methods
Suggests: R.rsp, mzR
Maintainer: Xavier Domingo-Almenara <xavier.domingoa@eurecat.org>
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: https://scholar.google.es/citations?user=i-0XFxkAAAAJ&hl=en
Repository: CRAN
LazyData: yes
NeedsCompilation: yes
Encoding: UTF-8
Packaged: 2021-05-10 14:46:06 UTC; xavidomingo
Date/Publication: 2021-05-11 04:20:17 UTC
Built: R 4.0.5; x86_64-w64-mingw32; 2022-04-21 09:01:01 UTC; windows
Archs: i386, x64
