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Fix type in recursive functional call. Build and test #189: Commit 18068c0 pushed by lohedges
September 5, 2024 21:31 15m 29s feature_ghost_handling
feature_ghost_handling
September 5, 2024 21:31 15m 29s
Raise exception, don't print error. Build and test #188: Commit c1e155f pushed by lohedges
September 5, 2024 21:17 9m 58s feature_ghost_handling
feature_ghost_handling
September 5, 2024 21:17 9m 58s
Fix alchemical ion logging. Build and test #187: Commit 49e9f99 pushed by lohedges
September 2, 2024 15:37 14m 44s main
main
September 2, 2024 15:37 14m 44s
Merge pull request #53 from OpenBioSim/feature_alchemical_ion3 Build and test #186: Commit 6c23071 pushed by lohedges
August 13, 2024 14:49 21s main
main
August 13, 2024 14:49 21s
Improve search for existing ions Build and test #185: Pull request #53 synchronize by lohedges
August 13, 2024 14:43 15s feature_alchemical_ion3
feature_alchemical_ion3
August 13, 2024 14:43 15s
Add debug statement to show if ion was from system or template. Build and test #184: Commit 971421c pushed by lohedges
August 13, 2024 14:43 16m 50s feature_alchemical_ion3
feature_alchemical_ion3
August 13, 2024 14:43 16m 50s
Improve search for existing ions Build and test #183: Pull request #53 synchronize by lohedges
August 13, 2024 13:28 18s feature_alchemical_ion3
feature_alchemical_ion3
August 13, 2024 13:28 18s
Add alchemical ion test system with existing ions. Build and test #182: Commit c060577 pushed by lohedges
August 13, 2024 13:28 13m 28s feature_alchemical_ion3
feature_alchemical_ion3
August 13, 2024 13:28 13m 28s
Improve search for existing ions Build and test #181: Pull request #53 opened by lohedges
August 13, 2024 08:48 20s feature_alchemical_ion3
feature_alchemical_ion3
August 13, 2024 08:48 20s
More robust search for existing ions. Build and test #180: Commit c2f08f5 pushed by lohedges
August 13, 2024 08:43 16m 53s feature_alchemical_ion3
feature_alchemical_ion3
August 13, 2024 08:43 16m 53s
Merge pull request #52 from OpenBioSim/feature_alchemical_ion2 Build and test #177: Commit ac23beb pushed by lohedges
August 9, 2024 16:23 15s main
main
August 9, 2024 16:23 15s
Alchemical ion improvements Build and test #176: Pull request #52 synchronize by lohedges
August 9, 2024 15:07 17s feature_alchemical_ion2
feature_alchemical_ion2
August 9, 2024 15:07 17s
Default to None for charge_difference and check there are enough waters. Build and test #175: Commit bfa8b99 pushed by lohedges
August 9, 2024 15:07 17m 12s feature_alchemical_ion2
feature_alchemical_ion2
August 9, 2024 15:07 17m 12s
Alchemical ion improvements Build and test #174: Pull request #52 synchronize by lohedges
August 9, 2024 14:39 19s feature_alchemical_ion2
feature_alchemical_ion2
August 9, 2024 14:39 19s
Use correct charge difference in conditional. Build and test #173: Commit 5a56168 pushed by lohedges
August 9, 2024 14:39 18m 5s feature_alchemical_ion2
feature_alchemical_ion2
August 9, 2024 14:39 18m 5s
Alchemical ion improvements Build and test #172: Pull request #52 opened by lohedges
August 9, 2024 12:02 18s feature_alchemical_ion2
feature_alchemical_ion2
August 9, 2024 12:02 18s
Automatically keep charge constant unless user overrides. Build and test #171: Commit 51b1cf4 pushed by lohedges
August 9, 2024 12:00 1h 0m 3s feature_alchemical_ion2
feature_alchemical_ion2
August 9, 2024 12:00 1h 0m 3s
Merge pull request #51 from OpenBioSim/feature_alchemical_ion Build and test #170: Commit e06cd1f pushed by lohedges
August 7, 2024 10:53 16s main
main
August 7, 2024 10:53 16s
Add alchemical ion support Build and test #169: Pull request #51 synchronize by lohedges
July 19, 2024 11:10 13s feature_alchemical_ion
feature_alchemical_ion
July 19, 2024 11:10 13s
Update system with return value. Build and test #168: Commit ab86a73 pushed by lohedges
July 19, 2024 11:10 13m 25s feature_alchemical_ion
feature_alchemical_ion
July 19, 2024 11:10 13m 25s
Add alchemical ion support Build and test #167: Pull request #51 opened by lohedges
July 17, 2024 15:02 15m 54s feature_alchemical_ion
feature_alchemical_ion
July 17, 2024 15:02 15m 54s
Add test for creation of alchemical ions. Build and test #166: Commit f12716a pushed by lohedges
July 17, 2024 14:23 22m 48s feature_alchemical_ion
feature_alchemical_ion
July 17, 2024 14:23 22m 48s
Update Python version. Build and test #165: Commit fa2c8f3 pushed by lohedges
July 17, 2024 11:27 13m 15s feature_alchemical_ion
feature_alchemical_ion
July 17, 2024 11:27 13m 15s
Rename the reference topology file for trajectory loading. Build and test #164: Commit 6b7095b pushed by lohedges
July 17, 2024 11:17 7m 22s feature_alchemical_ion
feature_alchemical_ion
July 17, 2024 11:17 7m 22s
Convert the charge difference to an integer. Build and test #163: Commit 0a7c838 pushed by lohedges
July 17, 2024 11:03 6m 28s feature_alchemical_ion
feature_alchemical_ion
July 17, 2024 11:03 6m 28s