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Drop legacy .readthedocs.yml; .readthedocs.yaml is the active config Tests #45: Commit c508d12 pushed by bobbypaton
1m 50s master
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Graph Update: uv in /., /docs #1345092903 Dependency Graph #4: by dependabot Bot
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Refresh Read the Docs for v4.x; move hindered-rotor to v5.0 Tests #44: Commit 0ff766f pushed by bobbypaton
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Add end-to-end PES regression tests against azabor_PES_v2.yaml Tests #43: Commit 54fcb4b pushed by bobbypaton
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Drop stray GoodVibes_*.dat smoke-run output, broaden gitignore Tests #42: Commit 85372d5 pushed by bobbypaton
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Graph Update: uv in /. #1343934297 Dependency Graph #3: by dependabot Bot
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Fix CPU-time accounting and tighten warning/output formatting Tests #41: Commit bdac20a pushed by bobbypaton
1m 15s master
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Graph Update: uv in /. #1343896855 Dependency Graph #2: by dependabot Bot
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Rewrite PES on a 3-layer data model with Rich tables and JSON v0.4 Tests #40: Commit ba3d980 pushed by bobbypaton
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Add ROADMAP.md tracking v4.1 -> v4.2 -> v5.0 progression Tests #39: Commit 50f56a2 pushed by bobbypaton
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Redesign selectivity: N-way labels, structured result, dual-method ou… Tests #38: Commit 5fb8176 pushed by bobbypaton
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Add test coverage for sort and validation modules Tests #37: Commit f88abfa pushed by bobbypaton
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Clean up ruff lint findings Tests #36: Commit 5bc8b64 pushed by bobbypaton
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Graph Update: uv in /., /goodvibes #1343539721 Dependency Graph #1: by dependabot Bot
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Merge pull request #93 from patonlab/testing Tests #35: Commit c8500dc pushed by bobbypaton
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Testing Tests #34: Pull request #93 synchronize by bobbypaton
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Merge pull request #94 from patonlab/coderabbitai/docstrings/97aaa68 Tests #33: Commit c040b0d pushed by bobbypaton
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Testing Tests #32: Pull request #93 synchronize by bobbypaton
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Merge pull request #95 from patonlab/coderabbitai/autofix/97aaa68 Tests #31: Commit 08ed65f pushed by bobbypaton
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Testing Tests #30: Pull request #93 synchronize by bobbypaton
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Update docs/source/README.md Tests #29: Commit 97aaa68 pushed by bobbypaton
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Testing Tests #28: Pull request #93 opened by bobbypaton
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Fix CircleCI: install test extra, harden ASE importorskip Tests #27: Commit 7180565 pushed by bobbypaton
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Fix CI: track xtb .xyz fixtures, ignore imaginary modes in ASE TS test Tests #26: Commit 5062291 pushed by bobbypaton
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Expand Q-Chem thermo tests to mirror G16 coverage Tests #25: Commit b04c32c pushed by bobbypaton
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