search

ardigen / MAT

The official implementation of the Molecule Attention Transformer.
MIT License
234 stars 57 forks source link

Access Feature vector #13

Open SK124 opened 4 years ago

SK124 commented 4 years ago

Hi! I am quite fascinated by your approach,I was wondering if we could tweak the present architecture or if the present architecture can give lets say a d dimensional feature vector of any SMILES molecule given to it,like a molecule fingerprint which can be used for other downstream tasks e.g. calculating two SMILES sequence similarity.

Thanks and Regards