Regarding the data in these two papers, I noticed that the SMILES strings are not explicitly listed. Could you please let me know if there is a way to access the molecular structures in SMILES format? I'm looking to generate ECFP features and would appreciate your guidance on this.
Regarding the data in these two papers, I noticed that the SMILES strings are not explicitly listed. Could you please let me know if there is a way to access the molecular structures in SMILES format? I'm looking to generate ECFP features and would appreciate your guidance on this.