Comments (2)
lohedges
commented on May 24, 2024
I've tried all other pairs of the CatS ligands and this is the only one that is non-symmetric. There appears to be nothing particularly special about the ligands. Strange.
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lohedges
commented on May 24, 2024
This is now fixed following the addition of the RDKit prematch. I'll close for now, but it would still be good to understand the reason for the problem in the underlying Sire MCS code.
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Related Issues (20)
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