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Don't include constrained bonds / angles from OpenFF (#116)
CI #439: Commit a3b8986 pushed by SimonBoothroyd
October 25, 2024 12:22 5m 0s main
October 25, 2024 12:22 5m 0s
Drop insider doc dependencies (#115)
CI #437: Commit cc9c847 pushed by SimonBoothroyd
October 20, 2024 12:40 4m 39s main
October 20, 2024 12:40 4m 39s
Drop insider doc dependencies
CI #436: Pull request #115 opened by SimonBoothroyd
October 20, 2024 12:34 4m 45s sb/drop-insiders
October 20, 2024 12:34 4m 45s
Add pydantic =1 support (#114)
CI #435: Commit 7d9ef1a pushed by SimonBoothroyd
September 30, 2024 00:43 4m 43s main
September 30, 2024 00:43 4m 43s
Add pydantic =1 support
CI #434: Pull request #114 synchronize by SimonBoothroyd
September 30, 2024 00:36 4m 38s sb/pydantic-v1
September 30, 2024 00:36 4m 38s
Add pydantic =1 support
CI #433: Pull request #114 synchronize by SimonBoothroyd
September 30, 2024 00:32 3m 1s sb/pydantic-v1
September 30, 2024 00:32 3m 1s
Add pydantic =1 support
CI #432: Commit 9624053 pushed by SimonBoothroyd
September 30, 2024 00:30 Failure sb/pydantic-v1
September 30, 2024 00:30 Failure
Detach parameter graph before OpenMM conversion (#113)
CI #426: Commit fe5d679 pushed by SimonBoothroyd
July 27, 2024 18:31 3m 53s main
July 27, 2024 18:31 3m 53s
Swap to ruff and setuptools-scm (#112)
CI #424: Commit 5220607 pushed by SimonBoothroyd
July 27, 2024 18:21 3m 59s main
July 27, 2024 18:21 3m 59s
Swap to ruff and setuptools-scm
CI #423: Pull request #112 opened by SimonBoothroyd
July 27, 2024 18:17 3m 55s sb/update-template
July 27, 2024 18:17 3m 55s
Allow converting NB potentials with no exclusions (#111)
CI #417: Commit 70bcca5 pushed by SimonBoothroyd
July 17, 2024 01:35 3m 57s main
July 17, 2024 01:35 3m 57s
July 17, 2024 00:55 4m 1s
Add support for advanced OpenFF handler converters
CI #414: Pull request #110 synchronize by SimonBoothroyd
July 17, 2024 00:50 4m 20s sb/openff-deps
July 17, 2024 00:50 4m 20s
Add support for advanced OpenFF handler converters
CI #413: Pull request #110 synchronize by SimonBoothroyd
July 17, 2024 00:48 2m 50s sb/openff-deps
July 17, 2024 00:48 2m 50s
Add support for advanced OpenFF handler converters
CI #412: Pull request #110 synchronize by SimonBoothroyd
July 17, 2024 00:39 3m 29s sb/openff-deps
July 17, 2024 00:39 3m 29s
Add support for advanced OpenFF handler converters
CI #411: Pull request #110 opened by SimonBoothroyd
July 15, 2024 12:21 2m 45s sb/openff-deps
July 15, 2024 12:21 2m 45s
[WIP] Add DampedExp6810 and multipole handlers / potentials
CI #410: Pull request #109 opened by aehogan
June 20, 2024 16:55 2m 29s aehogan:main
June 20, 2024 16:55 2m 29s
Don't hardcode built-in attrs, and fix docs (#108)
CI #409: Commit dafbe1c pushed by SimonBoothroyd
June 1, 2024 11:04 4m 3s main
June 1, 2024 11:04 4m 3s
Don't hardcode built-in attrs, and fix docs
CI #408: Pull request #108 opened by SimonBoothroyd
June 1, 2024 11:00 3m 53s sb/minor-cleanup
June 1, 2024 11:00 3m 53s
Add codecov upload token (#107)
CI #407: Commit b221c21 pushed by SimonBoothroyd
May 30, 2024 23:15 4m 5s main
May 30, 2024 23:15 4m 5s
Add codecov upload token
CI #406: Pull request #107 opened by SimonBoothroyd
May 30, 2024 23:08 3m 44s sb/add-codecov-token
May 30, 2024 23:08 3m 44s
Generalize OpenMM converters (#106)
CI #405: Commit 24f93a1 pushed by SimonBoothroyd
May 30, 2024 23:04 4m 26s main
May 30, 2024 23:04 4m 26s