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CluMSID

This is thedevelopment version of CluMSID; for the stable release version, seeCluMSID.

Clustering of MS2 Spectra for Metabolite Identification

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DOI: 10.18129/B9.bioc.CluMSID


Bioconductor version: Development (3.23)

CluMSID is a tool that aids the identification of features in untargeted LC-MS/MS analysis by the use of MS2 spectra similarity and unsupervised statistical methods. It offers functions for a complete and customisable workflow from raw data to visualisations and is interfaceable with the xmcs family of preprocessing packages.

Author: Tobias Depke [aut, cre], Raimo Franke [ctb], Mark Broenstrup [ths]

Maintainer: Tobias Depke <depke at mailbox.org>

Citation (from within R, entercitation("CluMSID")):

Installation

To install this package, start R (version "4.6") and enter:

if (!require("BiocManager", quietly = TRUE))    install.packages("BiocManager")# The following initializes usage of Bioc develBiocManager::install(version='devel')BiocManager::install("CluMSID")

For older versions of R, please refer to the appropriateBioconductor release.

Documentation

To view documentation for the version of this package installed in your system, start R and enter:

browseVignettes("CluMSID")
CluMSID DI-MS/MS TutorialHTMLR Script
CluMSID GC-EI-MS TutorialHTMLR Script
CluMSID LowRes TutorialHTMLR Script
CluMSID MTBLS TutorialHTMLR Script
CluMSID TutorialHTMLR Script
Reference ManualPDF
NEWSText
LICENSEText

Need some help? Ask on the Bioconductor Support site!

Details

biocViewsClustering,Metabolomics,Preprocessing,Software
Version1.27.0
In Bioconductor sinceBioC 3.9 (R-3.6) (6.5 years)
LicenseMIT + fileLICENSE
DependsR (>= 3.6)
ImportsmzR,S4Vectors,dbscan,RColorBrewer,ape,network,GGally,ggplot2,plotly, methods, utils, stats,sna, grDevices, graphics,Biobase,gplots,MSnbase
System Requirements
URLhttps://github.com/tdepke/CluMSID
Bug Reportshttps://github.com/tdepke/CluMSID/issues
See More
Suggestsknitr,rmarkdown,testthat,dplyr,readr,stringr,magrittr,CluMSIDdata,metaMS,metaMSdata,xcms
Linking To
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Build ReportBuild Report

Package Archives

FollowInstallation instructions to use this package in your R session.

Source PackageCluMSID_1.27.0.tar.gz
Windows Binary (x86_64) CluMSID_1.27.0.zip
macOS Binary (x86_64)
macOS Binary (arm64)
Source Repositorygit clone https://git.bioconductor.org/packages/CluMSID
Source Repository (Developer Access)git clone git@git.bioconductor.org:packages/CluMSID
Bioc Package Browserhttps://code.bioconductor.org/browse/CluMSID/
Package Short Urlhttps://bioconductor.org/packages/CluMSID/
Package Downloads ReportDownload Stats

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