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openforcefield / cmiles

Generate canonical molecule identifiers for quantum chemistry database
https://cmiles.readthedocs.io
MIT License
23 stars 7 forks source link

Ideas for future refactor #41

Open mattwthompson opened 4 years ago

mattwthompson commented 4 years ago

This is a "master" issue for tracking various ideas relating to a future refactor:

I've also added a refactor tag to track other issues.