Files
rdkit/Code/GraphMol/ChemTransforms/ChemTransforms.cpp
Gareth Jones bed7eb1eb5 Fixed R-group attachment positions in RGD (#5570)
* Fixed adding terminal dummy coordinates in replaceCore

* Restore precedence of guess of dummy atoms

* Reverse dummyAtomMap in RDKit::replaceCore
2022-09-20 06:35:13 +02:00

35 KiB