ramanspectrumpredictor_qm9 - RamanSpectrumPredictor_QM9 v2.6.7

This release, version 2.6.7, includes enhancements to the machine learning pipeline for predicting Raman spectra of organic molecules. We improved the accuracy of predictions by refining the RDKit descriptor calculations and optimizing the dataset handling. Users can now explore more robust results and a smoother experience.

- Python
Published by Kiks26-08 7 months ago