search

hsiaoyi0504 / awesome-cheminformatics

A curated list of Cheminformatics libraries and software.
681 stars 114 forks source link

SMILES enumeration for machine learning #15

Open hsiaoyi0504 opened 5 years ago

hsiaoyi0504 commented 4 years ago

https://arxiv.org/abs/1703.07076

hsiaoyi0504 commented 4 years ago

https://github.com/rdkit/rdkit/issues/2042

hsiaoyi0504 commented 4 years ago

https://github.com/titanda/Learn-it-all

hsiaoyi0504 commented 4 years ago

https://github.com/MarcusOlivecrona/REINVENT