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fix: add drug-discovery category to chem-msms-predict and chem-spectr… Deploy docs to GitHub Pages #109: Commit 242e0cb pushed by bowen-bd
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style: reformat test_atomate2_server.py with ruff-format Deploy docs to GitHub Pages #108: Commit 88fb0a9 pushed by bowen-bd
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style: reformat spectrum-matcher scripts and remove unused inchi vari… Deploy docs to GitHub Pages #107: Commit 58ea720 pushed by bowen-bd
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fix: fix SKILL.md frontmatter and update msms prediction scripts Deploy docs to GitHub Pages #106: Commit 2a45da5 pushed by bowen-bd
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Skip NValchemi relaxation on M3GNet/CHGNet and handle neighbor-list o… Deploy docs to GitHub Pages #105: Commit 6a13adf pushed by bowen-bd
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docs(release-standards): add curl validation step to release standards Deploy docs to GitHub Pages #104: Commit 44a75a3 pushed by bowen-bd
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docs(release-standards): add verbatim cleanup and gh release wrapper … Deploy docs to GitHub Pages #103: Commit 772ef1f pushed by bowen-bd
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docs: rebuild public site Deploy docs to GitHub Pages #102: Commit b87ff43 pushed by bowen-bd
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fix(tests): resolve multi-environment import errors and test assertions Deploy docs to GitHub Pages #101: Commit 856627a pushed by bowen-bd
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Refactor: Relocate generative model wrappers (ADiT, DiffCSP, MatterGe… Deploy docs to GitHub Pages #100: Commit cd60415 pushed by bowen-bd
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Merge pull request #38 from hugogontijomachado/fix/iceberg-public-che… Deploy docs to GitHub Pages #99: Commit 66f4cff pushed by bowen-bd
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docs(release-standards): fix workflow file naming and regex escape Deploy docs to GitHub Pages #98: Commit 6943450 pushed by bowen-bd
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fix: graceful src import and msms-agent ARM pytorch channel Deploy docs to GitHub Pages #97: Commit 522b420 pushed by bowen-bd
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Merge pull request #37 from mlederbauer/feat/mat-structured-synthesis… Deploy docs to GitHub Pages #96: Commit 73346ed pushed by bowen-bd
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Merge pull request #34 from mlederbauer/feat/chem-skills-msms Deploy docs to GitHub Pages #95: Commit 5475355 pushed by bowen-bd
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Merge pull request #36 from mlederbauer/feat/general-fair-data-review Deploy docs to GitHub Pages #94: Commit 578d1fc pushed by bowen-bd
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Merge pull request #35 from mlederbauer/feat/general-biorxiv-search Deploy docs to GitHub Pages #93: Commit 69fceee pushed by bowen-bd
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test(dft): add unit test for get_atomate2_project_status MCP tool Deploy docs to GitHub Pages #92: Commit 23d101d pushed by bowen-bd
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feat(dft): add permanent get_atomate2_project_status MCP tool for pro… Deploy docs to GitHub Pages #91: Commit f79d0e2 pushed by bowen-bd
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docs: add links to coding agents in README Deploy docs to GitHub Pages #90: Commit cc69516 pushed by bowen-bd
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docs(matgl): drop bandgap note from load_model docstring (linter clea… Deploy docs to GitHub Pages #89: Commit e097ddd pushed by bowen-bd
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docs: add Author column to New MCP Tools and New Workflows tables in … Deploy docs to GitHub Pages #88: Commit d8ffe30 pushed by bowen-bd
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feat: add ml-bayesian-optimization skill with lightweight GP+EI imple… Deploy docs to GitHub Pages #87: Commit 0adbc91 pushed by bowen-bd
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fix: rewrite cross-skill and workflow links for deployed doc site Deploy docs to GitHub Pages #86: Commit 22d73fa pushed by bowen-bd
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fix: remove mid-sentence colons in SKILL.md descriptions to fix YAML … Deploy docs to GitHub Pages #85: Commit 507d396 pushed by bowen-bd
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