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Merged
atravitz merged 1 commit into from
Jun 13, 2025
Merged

comment out TODO that was getting rendered #1375

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1 change: 1 addition & 0 deletions docs/guide/setup/creating_atom_mappings_and_scores.rst
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Expand Up @@ -16,6 +16,7 @@ The :class:`.LigandAtomMapper` takes pairs of :class:`openfe.SmallMoleculeCompon

Built in to the ``openfe`` package are bindings to the `Lomap <https://github.com/OpenFreeEnergy/Lomap>`_ package,
including the :class:`.openfe.setup.LomapAtomMapper`, which uses an MCS approach based on RDKit.

.. TODO: insert example output

This is how we can create a mapping between two ligands:
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