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DESCRIPTION
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Package: MetCirc
Type: Package
Title: Navigating mass spectral similarity in high-resolution MS/MS
metabolomics data
Version: 1.17.0
Date: 2019-10-21
Authors@R: c(person(given = "Thomas", family = "Naake",
email = "thomasnaake@googlemail.com",
role = c("aut","cre")),
person(given = "Emmanuel", family = "Gaquerel",
email = "emmanuel.gaquerel@ibmp-cnrs.unistra.fr", role = "aut"))
Author: Thomas Naake <thomasnaake@googlemail.com> and Emmanuel Gaquerel
<emmanuel.gaquerel@ibmp-cnrs.unistra.fr>
Maintainer: Thomas Naake <thomasnaake@googlemail.com>
VignetteBuilder: knitr
Depends:
R (>= 3.5),
amap (>= 0.8),
circlize (>= 0.3.9),
scales (>= 0.3.0),
shiny (>= 1.0.0),
MSnbase (>= 2.10.1),
Imports:
ggplot2 (>= 3.2.1),
S4Vectors (>= 0.22.0)
Suggests:
BiocGenerics,
graphics (>= 3.5),
grDevices (>= 3.5),
knitr (>= 1.11),
methods (>= 3.5),
stats (>= 3.5),
testthat (>= 2.2.1)
biocViews: ImmunoOncology, Metabolomics, MassSpectrometry, Visualization
Description: MetCirc comprises a workflow to interactively explore
high-resolution MS/MS metabolomics data. MetCirc uses the Spectrum2 and
Spectra infrastructure defined in the package MSnbase that stores
MS/MS spectra. MetCirc offers functionality to calculate
similarity between precursors based on the normalised dot product, neutral
losses or user-defined functions and
visualise similarities in a circular layout. Within the interactive framework
the user can annotate MS/MS features based on their similarity to
(known) related MS/MS features.
License: GPL (>= 3)
RoxygenNote: 6.1.1