Hello all,
I'm compiling OB on the following system: "An SGI Altix ICE 8200EX
with 320 compute nodes. Each compute node has two Intel (Harpertown)
Xeon E5462 quad-core processors and 16GB of RAM.". It's running SuSE
Linux Enterprise Server (64-bit).
Trunk OpenBabel compiles fine (with cmake) and babel lists all
formats, but I am having problems getting the Python interface to work
correctly. It's a bit strange actually.
>>> import openbabel
>>> conv = openbabel.OBConversion()
>>> conv.GetSupportedInputFormat()
('acr -- ACR format', 'adfout -- ADF output format', ..., ..., 'sdf --
MDL MOL format', 'smi -- SMILES format', 'smiles -- SMILES format',
...)
# 104 are present
>>> conv.SetInFormat("smi")
False
# That is, it couldn't set the input format to smi
So...GetSupportedInputFormat can find them, but SetInFormat cannot. Any ideas?
- Noel
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