[Rdkit-discuss] Errors with RDKit

Hello, My code is very simple: suppl4 = Chem.SDMolSupplier("/Volumes/MyPassportForMac/chembl_23.sdf") i = 0 for mol in suppl4: smile = Chem.MolToSmiles(mol,isomericSmiles=True) fingerpri = get_fp_rdkit(mol) namenmol = mol.GetProp("_Name") patron[namenmol]=fingerpri

Re: [Rdkit-discuss] Errors with RDKit

Hi Carlos, insert this in your loop: if not mol: continue Kind regards, Axel On 23.01.2018 03:59, Carlos Faerman wrote: Hello, My code is very simple: suppl4 = Chem.SDMolSupplier("/Volumes/MyPassportForMac/chembl_23.sdf") i = 0 for mol in suppl4: smile = Chem.MolToSmiles(mol,isome