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Improved tmp_files removal and added ipython docstring
tests #50: Commit f4e4519 pushed by gbayarri
January 22, 2025 12:18 30m 40s master
January 22, 2025 12:18 30m 40s
citation wf
tests #49: Commit 86307be pushed by gbayarri
January 21, 2025 15:29 32m 50s master
January 21, 2025 15:29 32m 50s
Added PR tests
tests #48: Commit 3e307da pushed by gbayarri
January 8, 2025 11:45 31m 50s master
January 8, 2025 11:45 31m 50s
2024.2
tests #47: Commit 51b6d67 pushed by PauAndrio
November 15, 2024 12:19 49m 32s master
November 15, 2024 12:19 49m 32s
Merge branch 'master' of github.com:bioexcel/biobb_chemistry
tests #46: Commit d24942a pushed by PauAndrio
November 14, 2024 15:24 46m 19s master
November 14, 2024 15:24 46m 19s
2024.2
tests #45: Commit aa1f841 pushed by gbayarri
November 7, 2024 09:34 43m 51s master
November 7, 2024 09:34 43m 51s
Added amber2gmx new tool
tests #44: Commit 881192c pushed by gbayarri
November 7, 2024 08:47 39m 45s master
November 7, 2024 08:47 39m 45s
2024.2
tests #43: Commit a080f48 pushed by PauAndrio
November 5, 2024 14:06 38m 19s master
November 5, 2024 14:06 38m 19s
[CI/CD](linting_and_testing.yml): Update set-up micromamba.
tests #42: Commit f324c6d pushed by PauAndrio
November 4, 2024 09:35 49m 36s master
November 4, 2024 09:35 49m 36s
Merge pull request #11 from PabloNA97/acpypeConvertAMBERtoGMX
tests #41: Commit 405e5c7 pushed by gbayarri
October 25, 2024 06:39 1d 1h 11m 7s master
October 25, 2024 06:39 1d 1h 11m 7s
[TYPING](ALL): Fix typing problems
tests #40: Commit fcd8584 pushed by PauAndrio
October 17, 2024 09:17 1h 14m 47s master
October 17, 2024 09:17 1h 14m 47s
[TYPING](ALL): Fix typing problems
tests #39: Commit 7be16f8 pushed by PauAndrio
October 17, 2024 09:12 48m 5s master
October 17, 2024 09:12 48m 5s
2024.2
tests #38: Commit 4b3f93d pushed by PauAndrio
October 16, 2024 14:50 8m 56s master
October 16, 2024 14:50 8m 56s
[UPDATE](tests): Update test reference data
tests #37: Commit 094c1e8 pushed by PauAndrio
October 16, 2024 14:30 4m 22s master
October 16, 2024 14:30 4m 22s
[CI/CD](TESTS): Ignoring typing in test files
tests #36: Commit a008145 pushed by PauAndrio
October 16, 2024 13:40 25m 32s master
October 16, 2024 13:40 25m 32s
[FEATURE](__init__): Importing submodules when a module is loaded
tests #35: Commit 7e4017a pushed by PauAndrio
October 16, 2024 13:37 5m 21s master
October 16, 2024 13:37 5m 21s
October 3, 2024 13:06 51m 18s
2024.1
tests #33: Commit 898678f pushed by gbayarri
July 16, 2024 14:04 28m 4s master
July 16, 2024 14:04 28m 4s
Merge branch 'master' of github.com:bioexcel/biobb_chemistry
tests #32: Commit 2260c6a pushed by gbayarri
July 16, 2024 13:23 37m 29s master
July 16, 2024 13:23 37m 29s
July 3, 2024 18:36 27m 11s
[FEATURE] New sandbox_path property
tests #30: Commit 9e0f6c4 pushed by PauAndrio
June 14, 2024 15:19 1h 13m 19s master
June 14, 2024 15:19 1h 13m 19s
citation GitHub Action
tests #29: Commit 347abd8 pushed by gbayarri
May 28, 2024 08:03 24m 21s master
May 28, 2024 08:03 24m 21s
2024.1
tests #28: Commit bf4d432 pushed by gbayarri
May 24, 2024 08:01 35m 27s master
May 24, 2024 08:01 35m 27s
Testing biobb_common 4.2.0
tests #27: Commit 3a72dd0 pushed by gbayarri
May 24, 2024 07:29 28m 8s master
May 24, 2024 07:29 28m 8s
Fair sw test
tests #26: Commit 6bb89ec pushed by gbayarri
May 7, 2024 08:00 33m 15s master
May 7, 2024 08:00 33m 15s