An R package to analyse LC/MS metabolomic data: MAIT (Metabolite Automatic Identification Toolkit)

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dc.contributor.authorFernández Albert, Francesc
dc.contributor.authorLlorach, Rafael
dc.contributor.authorAndrés Lacueva, Ma. Cristina
dc.contributor.authorPerera Lluna, Alexandre
dc.date.accessioned2017-03-06T13:28:19Z
dc.date.available2017-03-06T13:28:19Z
dc.date.issued2014-03-17
dc.date.updated2017-03-06T13:28:19Z
dc.description.abstractCurrent tools for liquid chromatography and mass spectrometry for metabolomic data cover a limited number of processing steps, whereas online tools are hard to use in a programmable fashion. This article introduces the Metabolite Automatic Identification Toolkit (MAIT) package, which makes it possible for users to perform metabolomic end-to-end liquid chromatography and mass spectrometry data analysis. MAIT is focused on improving the peak annotation stage and provides essential tools to validate statistical analysis results. MAIT generates output files with the statistical results, peak annotation and metabolite identification. AVAILABILITY AND IMPLEMENTATION: http://b2slab.upc.edu/software-and-downloads/metabolite-automatic-identification-toolkit/.
dc.format.extent2 p.
dc.format.mimetypeapplication/pdf
dc.identifier.idgrec644325
dc.identifier.issn1367-4803
dc.identifier.pmid24642061
dc.identifier.urihttps://hdl.handle.net/2445/107941
dc.language.isoeng
dc.publisherOxford University Press
dc.relation.isformatofReproducció del document publicat a: https://doi.org/10.1093/bioinformatics/btu136
dc.relation.ispartofBioinformatics, 2014, vol. 30, num. 13, p. 1937-1938
dc.relation.urihttps://doi.org/10.1093/bioinformatics/btu136
dc.rightscc-by-nc (c) , 2014
dc.rights.accessRightsinfo:eu-repo/semantics/openAccess
dc.rights.urihttp://creativecommons.org/licenses/by-nc/3.0/es
dc.sourceArticles publicats en revistes (Nutrició, Ciències de l'Alimentació i Gastronomia)
dc.subject.classificationCromatografia de líquids d'alta resolució
dc.subject.classificationEspectrometria de masses
dc.subject.classificationMetabòlits
dc.subject.otherHigh performance liquid chromatography
dc.subject.otherMass spectrometry
dc.subject.otherMetabolites
dc.titleAn R package to analyse LC/MS metabolomic data: MAIT (Metabolite Automatic Identification Toolkit)
dc.typeinfo:eu-repo/semantics/article
dc.typeinfo:eu-repo/semantics/publishedVersion

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