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Greg Landrum 35e0e86cda switch mol_from_{smiles,smarts,ctab} to return null instead of failing when the molecule can not be built;

switch to using LayereredFingerprintMol2

2012-07-07 12:45:58 +00:00

..

switch mol_from_{smiles,smarts,ctab} to return null instead of failing when the molecule can not be built;

2012-07-07 12:45:58 +00:00