ChemistryAtlas Code
spectrochempy/spectrochempy
Spectra and analytical chemistryGitHubsource codechemistrydata-analysisdatasetsftirftir-data-analysisinfrarednmrnmr-datanmr-spectroscopy
SpectroChemPy is a framework for processing, analyzing and modeling spectroscopic data for chemistry with Python
Why it is useful: Spectra and analytical chemistry repository for chemistry, cheminformatics, molecular ML, simulation, synthesis, or drug discovery workflows.
GitHub signals: 176 stars, 34 forks, primary language: Python.
Homepage: https://www.spectrochempy.fr
Citation: GitHub repository: spectrochempy/spectrochempy