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@bodowd bodowd commented Feb 2, 2025

This PR adds the mol_to_rdkit_mol function.

The internal representation of a molecule in duckdb_rdkit has additional meta data in front of the binary RDKit molecule. mol_to_rdkit_mol will convert the duckdb_rdkit molecule to a RDKit compatible binary representation by stripping the metadata from the duckdb_rdkit molecule.

Also, this PR edits the documentation.

@bodowd bodowd merged commit 992341f into main Feb 2, 2025
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2 participants