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pages build and deployment
pages-build-deployment #31: by github-pages bot
December 15, 2024 00:28 30s gh-pages
December 15, 2024 00:28 30s
Changed the default forcefield to OPLSAA
Release #26: Release 2024.12.14 published by seamm
December 15, 2024 00:26 4m 37s
December 15, 2024 00:26 4m 37s
Merge pull request #38 from molssi-seamm/dev
CodeQL #39: Commit f9ded55 pushed by seamm
December 15, 2024 00:25 57s main
December 15, 2024 00:25 57s
Changed the default forcefield to OPLSAA
CodeQL #38: Pull request #38 synchronize by paulsaxe
December 15, 2024 00:23 1m 3s dev
dev
December 15, 2024 00:23 1m 3s
Not sure what the problem is!
BranchCI #44: Commit 1a027b0 pushed by paulsaxe
December 15, 2024 00:23 1m 49s dev
dev
December 15, 2024 00:23 1m 49s
Changed the default forcefield to OPLSAA
CodeQL #37: Pull request #38 synchronize by paulsaxe
December 15, 2024 00:18 1m 11s dev
dev
December 15, 2024 00:18 1m 11s
Not sure what the problem is!
BranchCI #43: Commit ec995b8 pushed by paulsaxe
December 15, 2024 00:18 1m 52s dev
dev
December 15, 2024 00:18 1m 52s
Changed the default forcefield to OPLSAA
CodeQL #36: Pull request #38 synchronize by paulsaxe
December 15, 2024 00:10 1m 13s dev
dev
December 15, 2024 00:10 1m 13s
Updated for changes in SMILES handling
BranchCI #42: Commit 59ccb1f pushed by paulsaxe
December 15, 2024 00:10 1m 40s dev
dev
December 15, 2024 00:10 1m 40s
Changed the default forcefield to OPLSAA
CodeQL #35: Pull request #38 opened by paulsaxe
October 25, 2024 14:46 2m 10s dev
dev
October 25, 2024 14:46 2m 10s
Changed the default forcefield to OPLSAA
BranchCI #41: Commit 2cf5ffc pushed by paulsaxe
October 25, 2024 14:45 1m 36s dev
dev
October 25, 2024 14:45 1m 36s
pages build and deployment
pages-build-deployment #30: by github-pages bot
June 30, 2024 19:31 25s gh-pages
June 30, 2024 19:31 25s
Bugfix: error submitting jobs with local forcefield files
Release #25: Release 2024.6.30 published by seamm
June 30, 2024 19:30 4m 2s
June 30, 2024 19:30 4m 2s
Merge pull request #37 from molssi-seamm/dev
CodeQL #34: Commit d558d84 pushed by seamm
June 30, 2024 19:29 2m 27s main
June 30, 2024 19:29 2m 27s
Bug: error submitting jobs with local forcefield files.
CodeQL #33: Pull request #37 opened by paulsaxe
June 30, 2024 19:19 2m 17s dev
dev
June 30, 2024 19:19 2m 17s
Bug: error submitting jobs with local forcefield files.
BranchCI #40: Commit 0fef802 pushed by paulsaxe
June 30, 2024 19:18 1m 53s dev
dev
June 30, 2024 19:18 1m 53s
pages build and deployment
pages-build-deployment #29: by github-pages bot
June 29, 2024 21:24 22s gh-pages
June 29, 2024 21:24 22s
Bugfix: factor of 2 for dihedrals and impropers in ligpargen
Release #24: Release 2024.6.29.1 published by seamm
June 29, 2024 21:22 4m 10s
June 29, 2024 21:22 4m 10s
Merge pull request #36 from molssi-seamm/dev
CodeQL #32: Commit 5b2eaa9 pushed by seamm
June 29, 2024 21:21 2m 21s main
June 29, 2024 21:21 2m 21s
Bugfix: factor of 2 for dihedrals and impropers in ligpargen
CodeQL #31: Pull request #36 synchronize by paulsaxe
June 29, 2024 21:19 2m 33s dev
dev
June 29, 2024 21:19 2m 33s
Updated history.
BranchCI #39: Commit f031b50 pushed by paulsaxe
June 29, 2024 21:19 1m 46s dev
dev
June 29, 2024 21:19 1m 46s
Bugfix: factor of 2 for dihedrals and impropers in ligpargen
CodeQL #30: Pull request #36 opened by paulsaxe
June 29, 2024 21:18 2m 22s dev
dev
June 29, 2024 21:18 2m 22s
Worked on documentation
BranchCI #38: Commit e7bf344 pushed by paulsaxe
June 29, 2024 21:14 1m 46s dev
dev
June 29, 2024 21:14 1m 46s
pages build and deployment
pages-build-deployment #28: by github-pages bot
June 29, 2024 14:14 26s gh-pages
June 29, 2024 14:14 26s
Added customizable local forcefields and access to LigParGen
Release #23: Release 2024.6.29 published by seamm
June 29, 2024 14:13 4m 37s
June 29, 2024 14:13 4m 37s