Dear Goutam, Probably you’re getting this error because you did not import the module correctly. If you use "from rdkit.Chem import Crippen” and replace "rdkit.Chem.Crippen.MolLogP(mol)” with "Crippen.MolLogP(mol)”, it should work properly.
Best regards, Lorenzo Fabbri, M.Sc. ---------------------- Academic e-mail: [email protected] Personal e-mail: [email protected] Website: https://lorenzo-fabbri-92.netlify.com On Nov 4, 2019, 2:50 PM +0100, Goutam Mukherjee <[email protected]>, wrote: > Dear Members, > > I want to calculate molar refractivity and logP values by using Crippen > module of rdKit. > https://www.rdkit.org/docs/source/rdkit.Chem.Crippen.html > > Could any one please help me how do I calculate the same. > > When I used the command, > ligand_pdb = "test.pdb" > mol=Chem.MolFromPDBFile(ligand_pdb) > rdkit.Chem.Crippen.MolLogP(mol) > > It says that, > AttributeError: module 'rdkit.Chem' has no attribute 'Crippen' > > How do I overcome this? > > Thanks for your help, > Goutam > _______________________________________________ > Rdkit-discuss mailing list > [email protected] > https://lists.sourceforge.net/lists/listinfo/rdkit-discuss
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