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Merge remote-tracking branch 'origin/develop' into orca-parser install-and-test-workflow #481: Commit c39f2d7 pushed by EBB2675
4m 1s orca-parser
orca-parser
4m 1s
Adapted schema to archive derived properties from MolecularDynamicsRe… install-and-test-workflow #480: Commit 068f93a pushed by Bernadette-Mohr
54s gromacs-parser_results
gromacs-parser_results
54s
Update repository with Cruft Update repository with Cruft #52: Scheduled
30s develop
develop
30s
devcontainers in /. - Update #1264621510 Dependabot Updates #67: by dependabot bot
27s develop
develop
27s
pages build and deployment pages-build-deployment #33: by github-pages bot
22s gh-pages
gh-pages
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Fixed typo in h5md_expl.md, conjugant->conjugate_gradient (#155) Deploy MkDocs Site #33: Commit f2f3ff4 pushed by Bernadette-Mohr
33s develop
develop
33s
Fixed typo in h5md_expl.md, conjugant->conjugate_gradient (#155) install-and-test-workflow #479: Commit f2f3ff4 pushed by Bernadette-Mohr
3m 57s develop
develop
3m 57s
WIP install-and-test-workflow #478: Commit 0687ab6 pushed by Bernadette-Mohr
2m 9s gromacs-parser_results
gromacs-parser_results
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Fixed typo in h5md_expl.md, conjugant->conjugate_gradient install-and-test-workflow #477: Commit 4310bc2 pushed by Bernadette-Mohr
3m 33s fix_typo_h5md_docs
fix_typo_h5md_docs
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Copilot code review Copilot code review #12: by Copilot AI
5m 19s refs/pull/155/head
refs/pull/155/head
5m 19s
Fixed typo in h5md_expl.md, conjugant->conjugate_gradient install-and-test-workflow #476: Commit e21c910 pushed by Bernadette-Mohr
46s fix_typo_h5md_docs
fix_typo_h5md_docs
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Fix pseudopot parsing from outcar install-and-test-workflow #475: Commit a1eabf2 pushed by ladinesa
2m 43s refactor/idiomatic-vasp-pseudopotential-parsing
refactor/idiomatic-vasp-pseudopotential-parsing
2m 43s
Extended atom parameter parsing to include chemical_symbol and atomic… install-and-test-workflow #474: Commit 25129cc pushed by Bernadette-Mohr
54s gromacs-parser_results
gromacs-parser_results
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Rebasing onto current develop install-and-test-workflow #473: Commit eef88b1 pushed by Bernadette-Mohr
47s gromacs-parser_results
gromacs-parser_results
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Added parsing of masses and (partial) charges install-and-test-workflow #472: Commit f9aa5cb pushed by Bernadette-Mohr
55s gromacs-parser_results
gromacs-parser_results
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Apply ruff formatting fixes from merge install-and-test-workflow #471: Commit d79d4a3 pushed by ndaelman-hu
2m 40s refactor/idiomatic-vasp-pseudopotential-parsing
refactor/idiomatic-vasp-pseudopotential-parsing
2m 40s
pages build and deployment pages-build-deployment #32: by github-pages bot
24s gh-pages
gh-pages
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Gromacs parse system hierarchy (#153) Deploy MkDocs Site #32: Commit 1d12c2d pushed by Bernadette-Mohr
39s develop
develop
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Gromacs parse system hierarchy (#153) install-and-test-workflow #470: Commit 1d12c2d pushed by Bernadette-Mohr
5m 29s develop
develop
5m 29s
Pruned water trajectories to reduce test time install-and-test-workflow #469: Commit 32dc268 pushed by Bernadette-Mohr
4m 0s gromacs_parse_system_hierarchy
gromacs_parse_system_hierarchy
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Move imports to module level (PLC0415 fix) install-and-test-workflow #468: Commit 9c19f8a pushed by ndaelman-hu
2m 35s refactor/idiomatic-vasp-pseudopotential-parsing
refactor/idiomatic-vasp-pseudopotential-parsing
2m 35s
Fix ruff check issues (E501 line too long) install-and-test-workflow #467: Commit d0315a6 pushed by ndaelman-hu
2m 41s refactor/idiomatic-vasp-pseudopotential-parsing
refactor/idiomatic-vasp-pseudopotential-parsing
2m 41s
Added negation exeption for test data log files to gitignore install-and-test-workflow #466: Commit 53a43f6 pushed by Bernadette-Mohr
11m 8s gromacs_parse_system_hierarchy
gromacs_parse_system_hierarchy
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pages build and deployment pages-build-deployment #31: by github-pages bot
22s gh-pages
gh-pages
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Fix QE parser error (#154) install-and-test-workflow #465: Commit e1c74e2 pushed by EBB2675
3m 10s develop
develop
3m 10s