e3fp
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ERROR|Error generating fingerprints for . Traceback (most recent call last):
Hi,
I am trying to generate fingerprintvectors 3d following this github "https://github.com/iwatobipen/3dfp/blob/master/sample_script.ipynb" and I get the next error.
could you help me please?
Thanks Pablo
@PARODBE sorry for the late reply. There's insufficient information here for me to replicate the issue. At the bare minimum, please provide a minimum code example including SMILES or a file containing the molecule that failed.
@sethaxen Hi! I had the same issue and it was due to empty string in _Name property of the rdkit molecule. Maybe this information will help to fix it.