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High Activity

Commits : Listings

Analyzed 2 days ago. based on code collected 3 days ago.
Nov 21, 2023 — Nov 21, 2024
Commit Message Contributor Files Modified Lines Added Lines Removed Code Location Date
expose preset color palettes to MinimalLib through JSON (#7853) More... about 1 month ago
Update `PUBCHEMSHAPE_URL` and remove patch code (#7900) More... about 2 months ago
Restore "oops, exponential is a pain" code snippet in the RGD algorithm (#7898) More... about 2 months ago
Another performance improvement in CIP labelling (#7854) More... about 2 months ago
Use smart pointer for bits. (#7884) More... about 2 months ago
Improve Morgan Fingerprint Performance (#7862) More... about 2 months ago
expose three ROMol methods which were not previously exposed to SWIG wrappers (#7895) More... about 2 months ago
Fix some mem errors in 2024.09.1 (#7867) More... about 2 months ago
Use smart pointer for buffer. (#7883) More... about 2 months ago
fix #7782 (#7783) More... about 2 months ago
[CI]: temporarily be explicit about using the macos-12 image (#7882) More... about 2 months ago
Simple speed up for CIPLabeler (#7826) More... about 2 months ago
Gitignore fix (#7861) More... about 2 months ago
Fix RDKit Year (#7863) More... about 2 months ago
Fixes #7685 (#7864) More... about 2 months ago
ready next release cycle (#7858) More... about 2 months ago
update README and tag release (#7855) More... about 2 months ago
Fixes #7689 (#7851) More... about 2 months ago
Run clang-format across everything (#7849) More... about 2 months ago
massive simplification of README.md (#7831) More... 2 months ago
Allow subsets of ring systems to match templates (#7468) More... 2 months ago
beta release prep (#7836) More... 2 months ago
Rename MolProcessing header (#7835) More... 2 months ago
Add overloads of MolOps::getMolFrags and MolOps::getMolFragsWithQuery (#7823) More... 2 months ago
Fixes #7731 (#7833) More... 2 months ago
add mol processing API (#7773) More... 2 months ago
consolidate numeric vectors (#7792) More... 2 months ago
Expose MMFF aromaticity model for SetAromaticity (#7765) More... 2 months ago
Update SA score to use FingerprintGenerators (#7795) More... 2 months ago
Drop mol_hash for legacy databases to enable upgrade to recent versions (#7804) More... 2 months ago