Greg Landrum wrote:
I have done binaries in the past and can do them again, but if you
don't mind playing along, I'd like to try iterating on the mac binary
a bit.
Yep, no problem. In that spirit…
I've used the system python to build and run everything:
~ > type python
python is hashed (/usr/bin/python)
I guess using fink's python was the problem. Using /usr/bin/python
made everything work:
>>> from rdkit import RDConfig
>>> from rdkit import rdBase
>>> from rdkit import Chem
>>> m = Chem.MolFromSmiles('Cc1ccccc1')
>>> m
<rdkit.Chem.rdchem.Mol object at 0x794ea0>
>>> m.GetNumAtoms()
7
If I have time I'll see if I can get fink's version of python working
with RDKit, but I don't think that using python 2.5 instead of 2.6
will be any problem. Thanks for the help with this! Let me know if
there's any more testing to be done on the OS X version.
--
Benjamin D. Esham | [email protected] | bdesham128 (AIM)
“Given that sooner or later we're all just going to die, what's
the point of learning about integers?” — Calvin