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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
Showing page 3 of 330
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Date
expose preset color palettes to MinimalLib through JSON (#7853)
Paolo Tosco
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about 1 month ago
Update `PUBCHEMSHAPE_URL` and remove patch code (#7900)
UENO, M.
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about 2 months ago
Restore "oops, exponential is a pain" code snippet in the RGD algorithm (#7898)
Paolo Tosco
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about 2 months ago
Another performance improvement in CIP labelling (#7854)
Dan Nealschneider
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about 2 months ago
Use smart pointer for bits. (#7884)
David Cosgrove
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about 2 months ago
Improve Morgan Fingerprint Performance (#7862)
Kevin Boyd
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about 2 months ago
expose three ROMol methods which were not previously exposed to SWIG wrappers (#7895)
Paolo Tosco
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about 2 months ago
Fix some mem errors in 2024.09.1 (#7867)
Ricardo Rodriguez
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about 2 months ago
Use smart pointer for buffer. (#7883)
David Cosgrove
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about 2 months ago
fix #7782 (#7783)
Paolo Tosco
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about 2 months ago
[CI]: temporarily be explicit about using the macos-12 image (#7882)
Greg Landrum
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about 2 months ago
Simple speed up for CIPLabeler (#7826)
Dan Nealschneider
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about 2 months ago
Gitignore fix (#7861)
PatrickPenner
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about 2 months ago
Fix RDKit Year (#7863)
Ricardo Rodriguez
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about 2 months ago
Fixes #7685 (#7864)
Ricardo Rodriguez
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about 2 months ago
ready next release cycle (#7858)
Greg Landrum
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about 2 months ago
update README and tag release (#7855)
Greg Landrum
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about 2 months ago
Fixes #7689 (#7851)
Greg Landrum
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about 2 months ago
Run clang-format across everything (#7849)
Greg Landrum
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about 2 months ago
massive simplification of README.md (#7831)
Greg Landrum
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2 months ago
Allow subsets of ring systems to match templates (#7468)
Nic Zonta
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2 months ago
beta release prep (#7836)
Greg Landrum
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2 months ago
Rename MolProcessing header (#7835)
Paolo Tosco
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2 months ago
Add overloads of MolOps::getMolFrags and MolOps::getMolFragsWithQuery (#7823)
David Cosgrove
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2 months ago
Fixes #7731 (#7833)
Greg Landrum
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2 months ago
add mol processing API (#7773)
Greg Landrum
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2 months ago
consolidate numeric vectors (#7792)
Brian Kelley
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2 months ago
Expose MMFF aromaticity model for SetAromaticity (#7765)
Juuso Lehtivarjo
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2 months ago
Update SA score to use FingerprintGenerators (#7795)
François Bérenger
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2 months ago
Drop mol_hash for legacy databases to enable upgrade to recent versions (#7804)
Maciej Wójcikowski
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2 months ago
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