Package: CorMID 0.3.1

CorMID: Correct Mass Isotopologue Distribution Vectors

In metabolic flux experiments tracer molecules (often glucose containing labelled carbon) are incorporated in compounds measured using mass spectrometry. The mass isotopologue distributions of these compounds needs to be corrected for natural abundance of labelled carbon and other effects, which are specific on the compound and ionization technique applied. This package provides functions to correct such effects in gas chromatography atmospheric pressure chemical ionization mass spectrometry analyses.

Authors:Jan Lisec [aut, cre]

CorMID_0.3.1.tar.gz
CorMID_0.3.1.zip(r-4.5)CorMID_0.3.1.zip(r-4.4)CorMID_0.3.1.zip(r-4.3)
CorMID_0.3.1.tgz(r-4.4-x86_64)CorMID_0.3.1.tgz(r-4.4-arm64)CorMID_0.3.1.tgz(r-4.3-x86_64)CorMID_0.3.1.tgz(r-4.3-arm64)
CorMID_0.3.1.tar.gz(r-4.5-noble)CorMID_0.3.1.tar.gz(r-4.4-noble)
CorMID_0.3.1.tgz(r-4.4-emscripten)CorMID_0.3.1.tgz(r-4.3-emscripten)
CorMID.pdf |CorMID.html
CorMID/json (API)

# Install 'CorMID' in R:
install.packages('CorMID', repos = c('https://janlisec.r-universe.dev', 'https://cloud.r-project.org'))

Peer review:

Bug tracker:https://github.com/janlisec/cormid/issues

Uses libs:
  • c++– GNU Standard C++ Library v3
Datasets:
  • isotopes - A data frame containing isotope information.
  • known_frags - The known fragments and their relative position to '[M+H]'.
  • precalc_idx - Pre-calculated index matrices to speed up calculations in function 'getMID'.
  • prep - Example data as used in function 'CorMID'.

On CRAN:

cpp

4.88 score 1 packages 3 scripts 327 downloads 5 exports 1 dependencies

Last updated 16 days agofrom:4dc1bb256e. Checks:1 OK, 8 NOTE. Indexed: yes.

TargetResultLatest binary
Doc / VignettesOKJan 17 2025
R-4.5-win-x86_64NOTEJan 17 2025
R-4.5-linux-x86_64NOTEJan 17 2025
R-4.4-win-x86_64NOTEJan 17 2025
R-4.4-mac-x86_64NOTEJan 17 2025
R-4.4-mac-aarch64NOTEJan 17 2025
R-4.3-win-x86_64NOTEJan 17 2025
R-4.3-mac-x86_64NOTEJan 17 2025
R-4.3-mac-aarch64NOTEJan 17 2025

Exports:CalcTheoreticalMDVCorMIDCountChemicalElementsgetMIDrecMID

Dependencies:Rcpp

CorMID

Rendered fromCorMID.Rmdusingknitr::rmarkdownon Jan 17 2025.

Last update: 2025-01-09
Started: 2022-03-25