Perform the complete processing of a set of proton nuclear magnetic resonance spectra from the free induction decay (raw data) and based on a processing sequence (macro-command file). An additional file specifies all the spectra to be considered by associating their sample code as well as the levels of experimental factors to which they belong. More detail can be found in Jacob et al. (2017) <doi:10.1007/s11306-017-1178-y>.
| Version: |
1.3.2 |
| Depends: |
R (≥ 3.1.0) |
| Imports: |
Rcpp (≥ 0.12.7), base64enc (≥ 0.1), MASS (≥ 7.3), Matrix, methods, scales, doParallel (≥ 1.0.11), foreach (≥ 1.4.4), igraph (≥ 1.2.1), impute (≥ 1.54.0), MassSpecWavelet (≥
1.46.0), ptw (≥ 1.9), signal (≥ 0.7), XML (≥ 3.98), ggplot2 (≥ 3.0.0), plotly (≥ 4.8.0), plyr (≥ 1.8.4), minqa (≥ 1.2.4) |
| LinkingTo: |
Rcpp |
| Suggests: |
knitr, rmarkdown |
| Published: |
2023-04-13 |
| DOI: |
10.32614/CRAN.package.Rnmr1D |
| Author: |
Daniel Jacob 
[cre, aut],
Catherine Deborde [ctb],
Marie Lefebvre [ctb] |
| Maintainer: |
Daniel Jacob <daniel.jacob at inrae.fr> |
| License: |
GPL-2 | GPL-3 [expanded from: GPL (≥ 2)] |
| Copyright: |
Institut national de recherche pour l’agriculture,
l’alimentation et l’environnement (INRAE) |
| URL: |
https://github.com/INRA/Rnmr1D |
| NeedsCompilation: |
yes |
| Materials: |
README |
| CRAN checks: |
Rnmr1D results |