Pass molecule creation options through molecule_bag_to_smiles#152
Merged
Pass molecule creation options through molecule_bag_to_smiles#152
molecule_bag_to_smiles#152Conversation
mrwnmsr
approved these changes
Apr 28, 2026
jla-gardner
approved these changes
Apr 28, 2026
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This PR allows for passing in
Moleculekwargs (e.g.make_rdkit_mol) when these are made through themolecule_bag_to_smilesandmolecule_bag_to_smiles_strictutilities.