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- WORDSIZE changed from 32 to 64 (nautyL1.a) - New -R switch for aromaticity detection filtering - New -h and -C switches for ring restrictions - Updated canonsdf utility Co-Authored-By: Claude Opus 4.6 <noreply@anthropic.com>
Co-Authored-By: Claude Opus 4.6 <noreply@anthropic.com>
macOS clang creates .dSYM directories when compiling with -g. Co-Authored-By: Claude Opus 4.6 <noreply@anthropic.com>
Co-Authored-By: Claude Opus 4.6 <noreply@anthropic.com>
Co-Authored-By: Claude Opus 4.6 <noreply@anthropic.com>
Co-Authored-By: Claude Opus 4.6 <noreply@anthropic.com>
Co-Authored-By: Claude Opus 4.6 <noreply@anthropic.com>
Co-Authored-By: Claude Opus 4.6 <noreply@anthropic.com>
- Fix nauty download URL: nauty29r3.tar.gz -> nauty2_9_3.tar.gz (404 fix) - README: use dynamic brew --prefix path for Homebrew symlink example - README: add -I /path/to/nauty to gcc compilation examples - CI: add C4H10 test to Windows build for parity with other platforms Co-Authored-By: Claude Opus 4.6 <noreply@anthropic.com>
GitHub has deprecated macos-13 (x86_64) runners. Use macos-14 and macos-15 (both arm64 Apple Silicon) for CI builds. Release workflow now produces a single macOS ARM64 binary. Co-Authored-By: Claude Opus 4.6 <noreply@anthropic.com>
Inspired by PR #3 (ferchault). Switch from Ubuntu 24.04 to Alpine 3.21 for both build and runtime stages. Static linking eliminates runtime dependencies, producing a ~9MB image instead of ~80MB. Co-Authored-By: Claude Opus 4.6 <noreply@anthropic.com>
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Summary
nautyL1.ainstead ofnautyW1.a)-Rswitch for aromaticity detection (filters duplicate Kekule structures)-h#/-h#:#for 6-membered cycle restrictions-C#/-C#:#for chord-free carbon 6-ring restrictionscanonsdfutilityv*tags — builds platform binaries and creates a draft GitHub releaseTest Plan
surge -u C6H6→ 217 structures (correct)surge -u C4H10→ 2 structures (correct)surge -S C3H8→CCC(correct SMILES)-R C10H8,-h2 C10H8🤖 Generated with Claude Code