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[BUG] Sire-to-RDKit doesn't preserve SDF tags #296

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lohedges opened this issue Feb 14, 2025 · 0 comments · Fixed by #299
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[BUG] Sire-to-RDKit doesn't preserve SDF tags #296

lohedges opened this issue Feb 14, 2025 · 0 comments · Fixed by #299
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The Sire-to-RDKit conversion doesn't preserve any SDF tags that have been loaded into the molecule, which are present in the sdf_data molecular property. These shoudld be added as properties of the RDKit molecule so that they can be preserved when writing to SDF via RDKit.
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Fix issues #296, #297, and #298 OpenBioSim/sire
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