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Merge pull request #385 from OpenBioSim/fix_381
Release Devel #101: Commit f3e3a9c pushed by lohedges
January 29, 2025 11:41 46m 37s devel
January 29, 2025 11:41 46m 37s
Fix issues 381, 382, and add a Mass type
Pull-Request #279: Pull request #385 opened by lohedges
January 27, 2025 16:39 41m 56s fix_381
January 27, 2025 16:39 41m 56s
Correctly sort gmx xvg files for analysis
Pull-Request #278: Pull request #384 synchronize by fjclark
January 24, 2025 16:29 41m 15s fjclark:bugfix-analyse-gromacs
January 24, 2025 16:29 41m 15s
Correctly sort gmx xvg files for analysis
Pull-Request #277: Pull request #384 opened by fjclark
January 24, 2025 16:26 41m 33s fjclark:bugfix-analyse-gromacs
January 24, 2025 16:26 41m 33s
Merge pull request #379 from OpenBioSim/fix_376
Release Devel #100: Commit 92662d6 pushed by lohedges
January 20, 2025 14:39 38m 29s devel
January 20, 2025 14:39 38m 29s
Fix issue #376
Pull-Request #276: Pull request #379 synchronize by lohedges
January 7, 2025 11:15 40m 12s fix_376
January 7, 2025 11:15 40m 12s
Fix issue #376
Pull-Request #275: Pull request #379 opened by lohedges
January 7, 2025 10:00 41m 0s fix_376
January 7, 2025 10:00 41m 0s
Merge pull request #375 from OpenBioSim/fix_sire_265
Release Devel #99: Commit 0effc8e pushed by lohedges
December 13, 2024 14:55 41m 23s devel
December 13, 2024 14:55 41m 23s
Add test to validate correct update of triclinic box vectors in SOMD
Pull-Request #274: Pull request #375 opened by lohedges
December 9, 2024 12:26 40m 46s fix_sire_265
December 9, 2024 12:26 40m 46s
Add test to validate preservation of SDF stereochemistry
Pull-Request #273: Pull request #373 opened by lohedges
December 4, 2024 11:50 33m 41s fix_sire_261
December 4, 2024 11:50 33m 41s
Merge pull request #366 from OpenBioSim/fix_amber_fep_mappings
Release Devel #98: Commit 357beaf pushed by lohedges
November 25, 2024 15:53 36m 22s devel
November 25, 2024 15:53 36m 22s
Make sure there is data for SOMD2 too.
Release Devel #97: Commit 8f8c2b9 pushed by lohedges
November 18, 2024 09:14 38m 54s devel
November 18, 2024 09:14 38m 54s
Fix indentation.
Release Devel #96: Commit 78bd7d0 pushed by lohedges
November 15, 2024 16:11 49m 46s devel
November 15, 2024 16:11 49m 46s
Merge pull request #368 from fjclark/feature-improved-mbar-errors
Release Devel #95: Commit c2876f0 pushed by lohedges
November 15, 2024 15:16 41m 55s devel
November 15, 2024 15:16 41m 55s
Fix AMBER FEP mappings
Pull-Request #272: Pull request #366 synchronize by lohedges
November 15, 2024 09:21 41m 9s fix_amber_fep_mappings
November 15, 2024 09:21 41m 9s
Fix AMBER FEP mappings
Pull-Request #271: Pull request #366 synchronize by lohedges
November 14, 2024 13:29 40m 40s fix_amber_fep_mappings
November 14, 2024 13:29 40m 40s
Fix AMBER FEP mappings
Pull-Request #270: Pull request #366 synchronize by lohedges
November 14, 2024 12:14 40m 49s fix_amber_fep_mappings
November 14, 2024 12:14 40m 49s
Fix AMBER FEP mappings
Pull-Request #269: Pull request #366 opened by lohedges
November 13, 2024 13:47 40m 14s fix_amber_fep_mappings
November 13, 2024 13:47 40m 14s
Merge pull request #361 from OpenBioSim/fix_347
Release Devel #94: Commit ba07e40 pushed by lohedges
October 29, 2024 11:22 51m 55s devel
October 29, 2024 11:22 51m 55s
Fix issue #347
Pull-Request #265: Pull request #361 opened by lohedges
October 28, 2024 16:02 36m 30s fix_347
October 28, 2024 16:02 36m 30s
Release Main
Release Main #87: Manually run by lohedges
October 24, 2024 14:16 24m 8s main
October 24, 2024 14:16 24m 8s
Release 2024.3.0
Pull-Request #263: Pull request #357 opened by lohedges
October 24, 2024 13:34 39m 22s release_2024.3.0
October 24, 2024 13:34 39m 22s