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:

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