🌈 A collaborative list of awesome tools for spectroscopy. Also, check:

Tidy data structure for infrared spectra and functions to handle and preprocess them.

Automated all-functionals infrared and Raman spectra, and phonons.

Productivity tools for FTIR

Code and data for IR spectra recognition. (Part of PhD dissertation)

Functions to analyse mid infrared spectra of peat samples

Spectral Nexus is a web application for data analysis, spectra classification and visualization.

Prototype algorithm that analyzes and classifies components based on filtered bands in FT-IR spectral data.

WIDEa (Web Interface for Data Exploration) is R-based software aiming to provide users with a range of functionalities to explore, manage, clean and analyse "big" environmental and (in/ex situ) experimental data.

Analysis software for hyperspectral scans and spectra acquired in mid-IR photo-induced force microscopy

Python script to parse VEDA4 outputs to a simple Excel spreadsheet

Automatic extraction of numerical data from a free IR spectra database via integration with WebPlotDigitizer.