Package: mssearchr 0.1.1
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.
Authors:
mssearchr_0.1.1.tar.gz
mssearchr_0.1.1.zip(r-4.5)mssearchr_0.1.1.zip(r-4.4)mssearchr_0.1.1.zip(r-4.3)
mssearchr_0.1.1.tgz(r-4.4-x86_64)mssearchr_0.1.1.tgz(r-4.4-arm64)mssearchr_0.1.1.tgz(r-4.3-x86_64)mssearchr_0.1.1.tgz(r-4.3-arm64)
mssearchr_0.1.1.tar.gz(r-4.5-noble)mssearchr_0.1.1.tar.gz(r-4.4-noble)
mssearchr_0.1.1.tgz(r-4.4-emscripten)mssearchr_0.1.1.tgz(r-4.3-emscripten)
mssearchr.pdf |mssearchr.html✨
mssearchr/json (API)
NEWS
# Install 'mssearchr' in R: |
install.packages('mssearchr', repos = c('https://andreysamokhin.r-universe.dev', 'https://cloud.r-project.org')) |
Bug tracker:https://github.com/andreysamokhin/mssearchr/issues
- massbank_alkanes - Mass spectra of alkanes
Last updated 5 months agofrom:6d28fe38ef. Checks:OK: 9. Indexed: yes.
Target | Result | Date |
---|---|---|
Doc / Vignettes | OK | Nov 23 2024 |
R-4.5-win-x86_64 | OK | Nov 23 2024 |
R-4.5-linux-x86_64 | OK | Nov 23 2024 |
R-4.4-win-x86_64 | OK | Nov 23 2024 |
R-4.4-mac-x86_64 | OK | Nov 23 2024 |
R-4.4-mac-aarch64 | OK | Nov 23 2024 |
R-4.3-win-x86_64 | OK | Nov 23 2024 |
R-4.3-mac-x86_64 | OK | Nov 23 2024 |
R-4.3-mac-aarch64 | OK | Nov 23 2024 |
Exports:LibrarySearchLibrarySearchUsingNistApiPreprocessMassSpectraReadMspWriteMsp
Dependencies:Rcpp
Readme and manuals
Help Manual
Help page | Topics |
---|---|
Perform the library search within R | LibrarySearch |
Perform the library search using an API from NIST | LibrarySearchUsingNistApi |
Mass spectra of alkanes | massbank_alkanes |
Pre-process mass spectra | PreprocessMassSpectra |
Read mass spectra from an msp-file (NIST format) | ReadMsp |
Write mass spectra in an msp-file (NIST format) | WriteMsp |