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rawDiag

Brings Orbitrap Mass Spectrometry Data to Life; Fast and Colorful

Bioconductor version: 3.23 · Package version: 1.8.0

Optimizing methods for liquid chromatography coupled to mass spectrometry (LC-MS) poses a nontrivial challenge. The rawDiag package facilitates rational method optimization by generating MS operator-tailored diagnostic plots of scan-level metadata. The package is designed for use on the R shell or as a Shiny application on the Orbitrap instrument PC.

Installation

if (!require("BiocManager", quietly = TRUE))
    install.packages("BiocManager")

BiocManager::install("rawDiag")

Details

MaintainerChristian Panse <cp@fgcz.ethz.ch>
AuthorChristian Panse [aut, cre] (ORCID: <https://orcid.org/0000-0003-1975-3064>), Christian Trachsel [aut], Tobias Kockmann [aut]
LicenseGPL-3
URLhttps://github.com/fgcz/rawDiag/
Bug Reportshttps://github.com/fgcz/rawDiag/issues
Downloads rank179
Source branchRELEASE_3_23
biocViewsInfrastructure, MassSpectrometry, Metabolomics, Proteomics, ShinyApps, Software

Documentation

Download

Dependencies

Depends: R (>= 4.4)

Imports: dplyr, ggplot2 (>= 3.4), grDevices, hexbin, htmltools, BiocManager, BiocParallel, rawrr (>= 1.15.5), rlang, reshape2, scales, shiny (>= 1.5), stats, utils

Suggests: BiocStyle (>= 2.28), ExperimentHub, tartare, knitr, testthat