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mssearchr: Library Search Against Electron Ionization Mass Spectral Databases

Perform library searches against electron ionization mass spectral databases using either the API provided by 'MS Search' software (<https://chemdata.nist.gov/dokuwiki/doku.php?id=chemdata:nistlibs>) or custom implementations of the Identity and Similarity algorithms.

Version: 0.1.1
Depends: R (≥ 3.5.0)
Imports: Rcpp
LinkingTo: Rcpp
Suggests: testthat (≥ 3.0.0)
Published: 2024-06-25
DOI: 10.32614/CRAN.package.mssearchr
Author: Andrey Samokhin ORCID iD [aut, cre, cph]
Maintainer: Andrey Samokhin <andrey.s.samokhin at gmail.com>
BugReports: https://github.com/AndreySamokhin/mssearchr/issues
License: MIT + file LICENSE
URL: https://mass-spec.ru/projects/gcmsdata/mssearchr/eng/
NeedsCompilation: yes
Materials: README NEWS
CRAN checks: mssearchr results

Documentation:

Reference manual: mssearchr.pdf

Downloads:

Package source: mssearchr_0.1.1.tar.gz
Windows binaries: r-devel: mssearchr_0.1.1.zip, r-release: mssearchr_0.1.1.zip, r-oldrel: mssearchr_0.1.1.zip
macOS binaries: r-release (arm64): mssearchr_0.1.1.tgz, r-oldrel (arm64): mssearchr_0.1.1.tgz, r-release (x86_64): mssearchr_0.1.1.tgz, r-oldrel (x86_64): mssearchr_0.1.1.tgz

Linking:

Please use the canonical form https://CRAN.R-project.org/package=mssearchr to link to this page.

These binaries (installable software) and packages are in development.
They may not be fully stable and should be used with caution. We make no claims about them.