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pages build and deployment
pages-build-deployment #26: by github-pages bot
January 21, 2025 18:47 22s gh-pages
January 21, 2025 18:47 22s
Bugfix: torsions in 3-membered rings
Release #12: Release 2025.1.21 published by seamm
January 21, 2025 18:46 4m 5s
January 21, 2025 18:46 4m 5s
Merge pull request #67 from molssi-seamm/dev
CodeQL #16: Commit 7e63b8a pushed by seamm
January 21, 2025 18:45 1m 15s main
January 21, 2025 18:45 1m 15s
Merge pull request #67 from molssi-seamm/dev
CI #104: Commit 7e63b8a pushed by seamm
January 21, 2025 18:45 3m 24s main
January 21, 2025 18:45 3m 24s
Bugfix: torsions in 3-membered rings
CodeQL #15: Pull request #67 opened by paulsaxe
January 21, 2025 18:41 1m 23s dev
dev
January 21, 2025 18:41 1m 23s
Bugfix: torsions in 3-membered rings
CI #103: Pull request #67 opened by paulsaxe
January 21, 2025 18:41 3m 5s dev
dev
January 21, 2025 18:41 3m 5s
Bugfix: torsions in 3-membered rings
BranchCI #68: Commit 47942df pushed by paulsaxe
January 21, 2025 18:41 1m 31s dev
dev
January 21, 2025 18:41 1m 31s
pages build and deployment
pages-build-deployment #25: by github-pages bot
January 3, 2025 22:45 25s gh-pages
January 3, 2025 22:45 25s
Added scale factor for force constants
Release #11: Release 2025.1.3 published by seamm
January 3, 2025 22:44 3m 48s
January 3, 2025 22:44 3m 48s
Merge pull request #66 from molssi-seamm/dev
CodeQL #14: Commit 8fb705d pushed by seamm
January 3, 2025 22:43 1m 1s main
January 3, 2025 22:43 1m 1s
Merge pull request #66 from molssi-seamm/dev
CI #102: Commit 8fb705d pushed by seamm
January 3, 2025 22:43 2m 42s main
January 3, 2025 22:43 2m 42s
Added scale factor for force constants
CodeQL #13: Pull request #66 opened by paulsaxe
January 3, 2025 22:40 1m 1s dev
dev
January 3, 2025 22:40 1m 1s
Added scale factor for force constants
CI #101: Pull request #66 opened by paulsaxe
January 3, 2025 22:40 3m 9s dev
dev
January 3, 2025 22:40 3m 9s
Added support for scale factors for handling e.g. 1/2 in force consta…
BranchCI #67: Commit ca99897 pushed by paulsaxe
January 3, 2025 22:38 1m 23s dev
dev
January 3, 2025 22:38 1m 23s
pages build and deployment
pages-build-deployment #24: by github-pages bot
June 28, 2024 17:05 25s gh-pages
June 28, 2024 17:05 25s
Support for customized forcefields and enhanced citations
Release #10: Release 2024.6.27 published by seamm
June 28, 2024 17:04 3m 47s
June 28, 2024 17:04 3m 47s
Merge pull request #65 from molssi-seamm/dev
CodeQL #12: Commit 2e71585 pushed by seamm
June 28, 2024 05:25 2m 0s main
June 28, 2024 05:25 2m 0s
Merge pull request #65 from molssi-seamm/dev
CI #100: Commit 2e71585 pushed by seamm
June 28, 2024 05:25 1m 55s main
June 28, 2024 05:25 1m 55s
Support for local forcefield files
CI #99: Pull request #65 synchronize by paulsaxe
June 27, 2024 14:25 3m 47s dev
dev
June 27, 2024 14:25 3m 47s
Support for local forcefield files
CodeQL #11: Pull request #65 synchronize by paulsaxe
June 27, 2024 14:25 2m 2s dev
dev
June 27, 2024 14:25 2m 2s
Added missing dependency on rdkit.
BranchCI #66: Commit e85b5f5 pushed by paulsaxe
June 27, 2024 14:25 1m 22s dev
dev
June 27, 2024 14:25 1m 22s
Support for local forcefield files
CI #98: Pull request #65 synchronize by paulsaxe
June 27, 2024 14:05 1m 12s dev
dev
June 27, 2024 14:05 1m 12s
Support for local forcefield files
CodeQL #10: Pull request #65 synchronize by paulsaxe
June 27, 2024 14:05 2m 21s dev
dev
June 27, 2024 14:05 2m 21s
Updated versioneer for new Pythons
BranchCI #65: Commit ce782a7 pushed by paulsaxe
June 27, 2024 14:05 1m 16s dev
dev
June 27, 2024 14:05 1m 16s
Support for local forcefield files
CI #97: Pull request #65 opened by paulsaxe
June 27, 2024 14:02 1m 8s dev
dev
June 27, 2024 14:02 1m 8s