COMMITS
July 17, 2026
G
make sure embedding runs have RNG seeds set (#9409)
Greg Landrum committed
July 16, 2026
G
make the distgeom CI tests more verbose (#9402)
Greg Landrum committed
D
Only use ignoreAtomMapNumbers if canonicalising. (#9396)
David Cosgrove committed
July 15, 2026
N
Speedup testDGeomHelpers (#9388)
Niels Maeder committed
July 14, 2026
G
some cleanups of the SimDivPickers tests (#9397)
Greg Landrum committed
G
Fixes #9381 (#9393)
Greg Landrum committed
E
Fix race in MinimalLib test_substruct_library JS test (#9392)
Emily Rhodes committed
E
Fix flaky DiversityPickerTests.test3. (#9395)
Emily Rhodes committed
July 13, 2026
K
Removed redundant code (#9389)
Katharina Buchthal committed
July 9, 2026
G
remove a couple of compiler warnings when compiling with -fhardened (#9385)
Greg Landrum committed
A
Adds SVE to BFGSOpt (#9216)
ajeyabsf committed
N
fix as suggested by greg (#9382)
Niels Maeder committed
July 8, 2026
I
Fall back to canonical Kekulize traversal when the fast path fails (#9380)
Inwan Yoo committed
July 6, 2026
N
All-In-One coordinate refinement for ETKDG (#9292)
Niels Maeder committed
July 2, 2026
N
remove SVN leftovers (#9379)
Niels Maeder committed
G
fix rendering of mols with multiple highlights from PandasTools (#9377)
Greg Landrum committed
July 1, 2026
Y
Support cleaning CDXML NeedsClean atom's hydrogens (#9355)
Yakov Pechersky committed
Y
Support ChemDraw abnormal valence import (#9348)
Yakov Pechersky committed
June 26, 2026
N
Remove duplicate experimental torsion entry (#9374)
Niels Maeder committed
June 23, 2026
B
Use the same libexpat as the current python when building (#9369)
Brian Kelley committed
June 18, 2026
J
Update RDKit_Book.rst (#7946)
John Mayfield committed
June 17, 2026
S
Add opt-in unity (jumbo) builds + fix latent missing include guards (#9342)
Steven Kearnes committed
June 16, 2026
S
Fix latent -Wdeprecated-copy in Seed and SubstructTerm (#9352)
Steven Kearnes committed
J
Bugfix/rgd multicore targetmol crash (#9364)
Jon Swain committed
T
Fix DistGeomHelpers tests on arm64 (#9328)
tadhurst-cdd committed
Y
Y
Patch GetProp default typing in rdchem stubs (#9344)
Yakov Pechersky committed
R
make substructure search Ctrl+c interruptible (#9349)
Ricardo Rodriguez committed
T
Check OOB causing OSV-2022-1288 (#9361)
thomp-j committed
K
Refactore BoundsMatrixBuilder (#9337)
Katharina Buchthal committed