Repository Issue Activity (beta)

#9629 CalcNumAtomStereoCenters() changes after identity RenumberAtoms() on bicyclic amines

#7525 `-Wdocumentation` error

#9624 Clarify mol_from_smiles vs qmol_from_smarts for substruct_count queries in Postgresql cartridge

#9623 Add mol_numatoms/mol_numheavyatoms support for qmol in Postgresql cartridge

#9601 Tracking: nanobind wrapper improvements

#9617 Improve depiction of RNA

#8317 Specify more precise names for similarities in RDKit

#9607 Depiction code doesn't recognize AtomAtomicNum as a list query

#9604 MolsFromChemDrawBlock needs a version with explicit AUTO/CDX/CDXML support

#7726 Embed Molecule numerical instability edge case?

#7917 Bug with assigning stereochemistry in multiprocessing

#9554 Enable Link-Time-Optimization for production builds

#9586 MolToInchi adds spurious /b stereo for symmetric ylidene with 2D coordinates

#9583 Tautomerization of macrocycle with in-ring STEREOANY double bond converts to STEREONONE

#9475 Incremental Smiles Parsing + Sanitization improvements

#9581 rdkit reports "Explicit valence for atom # 0 S, 7, is greater than permitted" for six-valent sulfur?

#9284 RDKit postgreSQL cartridge infinity loop

#9579 Apple Clang rejects emplace_back on aggregate Bounds struct in BoundsMatrixBuilderDetails.h (parenthesized aggregate init)

#9350 FindPotentialStereo missing from Java Wrappers

#9540 Shipped rdkit-stubs .pyi files are not valid Python, which stops mypy before it checks any user code

#9575 Conflicting prototypes for function distdriver()

#8108 assignStereochemistry does not handle Atropisomers

#9524 Bug in sascorer due to discontinuity in smoothing function

#9461 Bounds matrix: Extra squish for atoms at non-squish bonds

#8896 FindEigen3.cmake does not work with Eigen3 5.0