speaq - Tools for Nuclear Magnetic Resonance (NMR) Spectra Alignment,
Peak Based Processing, Quantitative Analysis and Visualizations
Makes Nuclear Magnetic Resonance spectroscopy (NMR
spectroscopy) data analysis as easy as possible by only
requiring a small set of functions to perform an entire
analysis. 'speaq' offers the possibility of raw spectra
alignment and quantitation but also an analysis based on
features whereby the spectra are converted to peaks which are
then grouped and turned into features. These features can be
processed with any number of statistical tools either included
in 'speaq' or available elsewhere on CRAN. More details can be
found in Vu et al. (2011) <doi:10.1186/1471-2105-12-405> and
Beirnaert et al. (2018) <doi:10.1371/journal.pcbi.1006018>.