Links

Here are links to some of my projects:

  • FOSS4Spectroscopy is a listing of free and open source (FOSS) software resources for spectroscopy. Most of the entries are packages for R and Python.
  • ChemoSpec is an R package for exploratory data analysis of one dimensional spectroscopic data sets such as IR, NMR, and Raman spectra.
  • ChemoSpec2D is an R package for exploratory data analysis of two dimensional NMR data sets.
  • readJDX is an R package for reading files in the JCAMP-DX format.
  • exCon is an R package which creates an interactive web page to explore topographic-like data sets. Such data is found in cartography, 2D spectroscopy and chemometrics. Demo
  • SpecHelpers is an R package with a number of spectroscopy-related utilities.