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97 workflow runs

Release v4.0.0: Java 25, SMSD 6.11.1, code modernization CI #139: Commit 0d66322 pushed by asad

31s

Polish benchmark report: 300 DPI charts, improved reaction images, RE… CI #138: Commit 6c02487 pushed by asad

35s

Fix three correctness and memory issues found in code review CI #137: Commit 6c48357 pushed by asad

22s

Publish to GitHub Packages on release tags only CI #136: Commit cb14f0b pushed by asad

24s

Restore MIXTURE to Phase 2 algorithm set CI #135: Commit 36e4f70 pushed by asad

45s

Share mapping executor across reactions; name threads for profiling CI #134: Commit 83d27b2 pushed by asad

56s

Suppress CDK deprecation and unchecked warnings in compiler config CI #133: Commit c5557c7 pushed by asad

6h 5m 3s master

6h 5m 3s

Bring all docs to v3.8.1: algorithm, changelog, bin README CI #132: Commit c355fa6 pushed by asad

6h 5m 4s master

6h 5m 4s

Release 3.8.1: SMSD 6.9.1, MolGraph canonical SMILES, benchmark refresh CI #131: Commit 98d0b3c pushed by asad

6h 5m 5s master

6h 5m 5s

Fix benchmark table: use chemically-equivalent metric for fair compar… CI #130: Commit 3abaa85 pushed by asad

6h 5m 4s master

6h 5m 4s

Make logo link to project repo CI #129: Commit 4606122 pushed by asad

6h 5m 5s master

6h 5m 5s

Drop Java 17-20 JVM flag incompatible with Java 21 CI #128: Commit 938b142 pushed by asad

6h 5m 4s master

6h 5m 4s

Refresh benchmark numbers post stereo-fix CI #127: Commit ddfa62e pushed by asad

10s

Fix stereo-blind identity shortcut and remove debug output CI #126: Commit 2716cf9 pushed by asad

9s

Restore README logo banner CI #125: Commit e9a382d pushed by asad

10s

Release 3.8.0 CI #124: Commit d927a10 pushed by asad

10s

Align all docs, benchmarks, and jar references to v3.7.0 CI #123: Commit 6cef3cb pushed by asad

6h 5m 4s master

6h 5m 4s

Add formal algorithm description for publication (ALGORITHM.md) CI #122: Commit 1042a4c pushed by asad

6h 5m 4s master

6h 5m 4s

Bump to v3.7.0, enhanced golden dataset benchmark with combined metrics CI #121: Commit a42b740 pushed by asad

6h 5m 5s master

6h 5m 5s

Merge dev: v3.6.1 security hardening, memory fixes, SMSD optimization CI #120: Commit 4df4734 pushed by asad

21m 30s master

21m 30s

Bump RDT version to 3.6.0 CI #119: Commit bd25a43 pushed by asad

23m 39s master

23m 39s

Upgrade SMSD to 6.3.0, replace CDK fingerprints with SMSD, update README CI #118: Commit 5a7f22f pushed by asad

23m 16s master

23m 16s

Add high-quality RDT logo (256x256 SVG) CI #117: Commit 312fa58 pushed by asad

21m 45s master

21m 45s

Use SMSD path fingerprints in ReactionFingerprinter and ReactionConta… CI #116: Commit 12a018c pushed by asad

21m 42s master

21m 42s

Upgrade to Java 21, replace cdk-bundle with 16 individual CDK modules… CI #115: Commit 54e5823 pushed by asad

23m 23s master

23m 23s