DESCRIPTION

Package: MSeasy
Type: Package
Title: Preprocessing of Gas Chromatography-Mass Spectrometry (GC-MS)
        data
Version: 5.3.3
Date: 2013-03-18
Depends: amap, clValid, cluster, fpc, mzR, xcms
Suggests: tcltk
Author: Elodie Courtois <courtoiselodie@gmail.com>, Yann Guitton
        <yann.guitton@gmail.com>, Florence Nicole
        <florence.nicole@univ-st-etienne.fr>
Maintainer: Yann GUITTON <yann.guitton@gmail.com>
Description: Package for the detection of molecules in complex mixtures
        of compounds. It creates an initial_DATA matrix from several
        GC-MS analyses by collecting and assembling the information
        from chromatograms and mass spectra (MS.DataCreation), It can
        read several format (ASCII, CDF, mzML, mzXML or mzData).It
        tests for the best unsupervised clustering method to group
        similar mass spectra into molecules (MS.test.clust).It runs the
        optimal unsupervised clustering method on the initial_DATA
        matrix, identifies the optimal number of clusters, produces
        different files for facilitating the quality control and
        identification of putative molecules, and returns
        fingerprinting or profiling matrices (MS.clust).It converts
        output files from MS.clust for NIST mass spectral library
        search and ARISTO webtool search
License: GPL-2
URL: http://sites.google.com/site/rpackagemseasy/
LazyData: yes
Packaged: 2013-03-19 16:52:04 UTC; chimimar
NeedsCompilation: no
Repository: CRAN
Date/Publication: 2013-03-20 17:07:31