Open mengchengyao opened 2 years ago
Thank you for your great tools, it helped me a lot. Now, I have a problem, How could I generating profiles(expression) for new chemicals from SMILES for new chemicals. Do you have any user guid or examples? Best wishes
I think you can use openbabel or RDkit in python to transform SMILES to png pictures.
Thank you for your great tools, it helped me a lot. Now, I have a problem, How could I generating profiles(expression) for new chemicals from SMILES for new chemicals. Do you have any user guid or examples? Best wishes