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Update zenodo CITATION.cff
cleanup caches by a branch #295: Pull request #846 closed by IAlibay
July 23, 2024 13:55 13s update-zenodo
July 23, 2024 13:55 13s
Fix OpenMMForceFields gaff tests version checks
cleanup caches by a branch #294: Pull request #893 closed by IAlibay
July 21, 2024 17:45 16s gaff-update
July 21, 2024 17:45 16s
[pre-commit.ci] pre-commit autoupdate
cleanup caches by a branch #293: Pull request #877 closed by IAlibay
July 3, 2024 20:09 15s pre-commit-ci-update-config
July 3, 2024 20:09 15s
fix cmap import
cleanup caches by a branch #292: Pull request #880 closed by mikemhenry
July 3, 2024 14:14 15s fix-cmap
July 3, 2024 14:14 15s
Pin matplotlib to <3.9.0
cleanup caches by a branch #291: Pull request #879 closed by IAlibay
July 3, 2024 12:58 15s pin-matplotlib
July 3, 2024 12:58 15s
update urls to match new scheme + add micromamba install steps
cleanup caches by a branch #290: Pull request #876 closed by IAlibay
June 27, 2024 23:33 14s update-conda-lock-urls
June 27, 2024 23:33 14s
add debug logging info
cleanup caches by a branch #289: Pull request #873 closed by IAlibay
June 21, 2024 03:48 15s feat/add_debug_logging_info
June 21, 2024 03:48 15s
Updated installation instructions for conda-lock
cleanup caches by a branch #288: Pull request #867 closed by IAlibay
June 13, 2024 10:39 12s fix/update_lock_file_instructions
June 13, 2024 10:39 12s
Build osx x86 installers
cleanup caches by a branch #286: Pull request #865 closed by mikemhenry
June 10, 2024 21:29 12s build_osx-x86-installers
June 10, 2024 21:29 12s
Force the old LomapAtomMapper kwarg defaults on extra test
cleanup caches by a branch #285: Pull request #862 closed by mikemhenry
May 31, 2024 23:04 16s hotfix-mapping
May 31, 2024 23:04 16s
Test lomap 3.1.0
cleanup caches by a branch #284: Pull request #861 closed by mikemhenry
May 31, 2024 22:51 12s DNM/test-lomap2
May 31, 2024 22:51 12s
Force the old LomapAtomMapper kwarg defaults on extra test
cleanup caches by a branch #283: Pull request #862 closed by IAlibay
May 31, 2024 22:33 5m 17s hotfix-mapping
May 31, 2024 22:33 5m 17s
[DNM] Test main versions of our tools
cleanup caches by a branch #282: Pull request #858 closed by IAlibay
May 31, 2024 20:57 24s test-main-tools
May 31, 2024 20:57 24s
Updated CHANGELOG for 1.0.1
cleanup caches by a branch #281: Pull request #860 closed by mikemhenry
May 31, 2024 20:48 12s release/1.0.1
May 31, 2024 20:48 12s
Test with main on Lomap dev branch
cleanup caches by a branch #280: Pull request #855 closed by mikemhenry
May 31, 2024 19:22 18s test-lomap-dev
May 31, 2024 19:22 18s
add osx-arm64 py312 test
cleanup caches by a branch #279: Pull request #853 closed by mikemhenry
May 16, 2024 16:51 13s test_py312_osx_arm64
May 16, 2024 16:51 13s
Add GAFF test (and GAFF skips) to CI
cleanup caches by a branch #278: Pull request #847 closed by mikemhenry
May 13, 2024 20:40 12s DNM/test-openmmff
May 13, 2024 20:40 12s
[DNM] Test python 3.12
cleanup caches by a branch #277: Pull request #850 closed by mikemhenry
May 10, 2024 22:13 14s test_python_3.12
May 10, 2024 22:13 14s
debug script for people to test openmm
cleanup caches by a branch #276: Pull request #733 closed by mikemhenry
May 6, 2024 19:57 16s feat/add_openmm_debug_script
May 6, 2024 19:57 16s
Save the Rainforest
cleanup caches by a branch #275: Pull request #839 closed by IAlibay
April 28, 2024 11:17 15s feat/save_the_rainforest
April 28, 2024 11:17 15s
pin macos runners to macos-12
cleanup caches by a branch #274: Pull request #841 closed by IAlibay
April 27, 2024 10:14 11s fix/use_x86_mac_os_runners
April 27, 2024 10:14 11s
Fix RTD flyout version selector
cleanup caches by a branch #273: Pull request #688 closed by mikemhenry
April 25, 2024 16:30 17s fix/css-404-errors
April 25, 2024 16:30 17s
fix installer
cleanup caches by a branch #272: Pull request #838 closed by mikemhenry
April 19, 2024 18:40 14s fix/improve_installer_building
April 19, 2024 18:40 14s
Adding paralllel max network planning
cleanup caches by a branch #271: Pull request #705 closed by RiesBen
April 19, 2024 16:27 11s parallelMaxGraphs
April 19, 2024 16:27 11s