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Fix spectrum weighting for MD-sampled geometries (#229) CI #717: Commit 76f6eff pushed by danielhollas
January 16, 2024 14:42 4m 12s main
main
January 16, 2024 14:42 4m 12s
Fix spectrum weighting for MD-sampled geometries CI #716: Pull request #229 opened by danielhollas
December 18, 2023 14:22 4m 13s fix-conformer-weights
fix-conformer-weights
December 18, 2023 14:22 4m 13s
Enable pylint and pylint refactor rules (#228) CI #715: Commit d4ab6ce pushed by danielhollas
October 26, 2023 23:18 5m 25s main
main
October 26, 2023 23:18 5m 25s
Enable pylint and pylint refactor rules CI #714: Pull request #228 opened by danielhollas
October 26, 2023 21:53 5m 47s pylint
pylint
October 26, 2023 21:53 5m 47s
Sort imports via isort lint in ruff (#227) CI #713: Commit a9095d9 pushed by danielhollas
October 24, 2023 23:18 5m 16s main
main
October 24, 2023 23:18 5m 16s
Isort lint CI #712: Pull request #227 synchronize by danielhollas
October 24, 2023 23:08 5m 9s isort
isort
October 24, 2023 23:08 5m 9s
Isort lint CI #711: Pull request #227 opened by danielhollas
October 24, 2023 22:22 5m 18s isort
isort
October 24, 2023 22:22 5m 18s
Skip no-commit-to-branch hook in CI (#226) CI #710: Commit 27343e1 pushed by danielhollas
October 23, 2023 19:21 7m 4s main
main
October 23, 2023 19:21 7m 4s
Remove setup.py CI #709: Pull request #183 synchronize by danielhollas
October 23, 2023 17:26 5m 12s remove-setup.py
remove-setup.py
October 23, 2023 17:26 5m 12s
Skip no-commit-to-branch hook in CI CI #708: Pull request #226 synchronize by danielhollas
October 23, 2023 14:58 5m 6s fix-precommit
fix-precommit
October 23, 2023 14:58 5m 6s
Skip no-commit-to-branch hook in CI CI #707: Pull request #226 synchronize by danielhollas
October 23, 2023 14:48 5m 19s fix-precommit
fix-precommit
October 23, 2023 14:48 5m 19s
Skip no-commit-to-branch hook in CI CI #706: Pull request #226 synchronize by danielhollas
October 23, 2023 14:46 5m 1s fix-precommit
fix-precommit
October 23, 2023 14:46 5m 1s
Skip no-commit-to-branch hook in CI CI #705: Pull request #226 synchronize by danielhollas
October 23, 2023 14:43 3m 32s fix-precommit
fix-precommit
October 23, 2023 14:43 3m 32s
Skip no-commit-to-branch hook in CI CI #704: Pull request #226 synchronize by danielhollas
October 23, 2023 14:39 4m 14s fix-precommit
fix-precommit
October 23, 2023 14:39 4m 14s
Skip no-commit-to-branch hook in CI CI #703: Pull request #226 opened by danielhollas
October 23, 2023 14:32 5m 30s fix-precommit
fix-precommit
October 23, 2023 14:32 5m 30s
Update linters, switch black to ruff format (#225) CI #702: Commit 8de5700 pushed by danielhollas
October 22, 2023 23:54 36s main
main
October 22, 2023 23:54 36s
Update linters CI #701: Pull request #225 synchronize by danielhollas
October 22, 2023 23:36 4m 21s update-linters
update-linters
October 22, 2023 23:36 4m 21s
Update linters CI #700: Pull request #225 synchronize by danielhollas
October 21, 2023 22:19 5m 11s update-linters
update-linters
October 21, 2023 22:19 5m 11s
Update linters CI #699: Pull request #225 synchronize by danielhollas
October 20, 2023 14:07 5m 19s update-linters
update-linters
October 20, 2023 14:07 5m 19s
Update linters CI #698: Pull request #225 synchronize by danielhollas
October 20, 2023 13:17 7m 1s update-linters
update-linters
October 20, 2023 13:17 7m 1s
Update linters CI #697: Pull request #225 synchronize by danielhollas
October 20, 2023 12:38 6m 45s update-linters
update-linters
October 20, 2023 12:38 6m 45s
Update linters CI #696: Pull request #225 opened by danielhollas
October 20, 2023 12:23 7m 37s update-linters
update-linters
October 20, 2023 12:23 7m 37s
WIP: More docs CI #695: Pull request #224 opened by danielhollas
October 20, 2023 10:06 4m 50s mkdoc-update
mkdoc-update
October 20, 2023 10:06 4m 50s
Install xtb and OpenMPI if needed (#221) CI #694: Commit 54081f8 pushed by danielhollas
October 9, 2023 16:16 6m 24s main
main
October 9, 2023 16:16 6m 24s
Install xtb and OpenMPI during app installation CI #693: Pull request #221 synchronize by danielhollas
October 4, 2023 17:37 5m 24s install-xtb-openmpi
install-xtb-openmpi
October 4, 2023 17:37 5m 24s