awesome-python-chemistry
See Also
Another list focuses on Python stuff related to Chemistry.
Source attribution
- Awesome Cheminformatics — github.com/lmmentel/awesome-python-chemistry
Related resources
Chemoinformatics and drug discovery section in deeplearning-biology repo.
A list of papers, data sets, and other resources for machine learning for small-molecule drug discovery.
A curated list of molecular docking software, datasets, and other closely related resources.