Boeselt et. al PhysChemChemPhys 2022

Release corresponding to the paper:

@article{Boeselt2022, title={Improving the IR Spectra Alignment Algorithm with Spectra Deconvolution and Combination with Raman or VCD Spectroscopy}, author={L. Boeselt and R. Aerts and W. Herrebout and S. Riniker}, journal={PhysChemChemPhys}}