Hi all,
I'm using the following query in postgresql (with the rdkit extension
installed):
"select casrn from mols where m @> CAST(? AS mol)"
This returns "ERROR: could not create molecule from SMILES '...' " on
occasion. One such SMILE that causes this error regularly is
'(C=C1)[N+]([O-])=O'. I'm curious if there's documentation on this
specific error message anywhere. I've looked and haven't had luck
finding any.
Any information about this error message is much appreciated.
Thanks,
Larson
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