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Action for reading masses and charges from a PDB file CI #2947: Pull request #1087 synchronize by gtribello
June 14, 2024 13:43 1h 1m 41s read-mass-charge-action
read-mass-charge-action
June 14, 2024 13:43 1h 1m 41s
Action for reading masses and charges from a PDB file CodeQL #755: Pull request #1087 synchronize by gtribello
June 14, 2024 13:43 20m 59s read-mass-charge-action
read-mass-charge-action
June 14, 2024 13:43 20m 59s
Added functionality to READMASSCHARGE so that you can read masses and… CI #2946: Commit 9398658 pushed by gtribello
June 14, 2024 13:43 1h 1m 25s read-mass-charge-action
read-mass-charge-action
June 14, 2024 13:43 1h 1m 25s
dynamically resolve environment variables CI #2945: Pull request #1088 opened by zhongxiang117
June 14, 2024 13:14 1h 0m 12s zhongxiang117:master
zhongxiang117:master
June 14, 2024 13:14 1h 0m 12s
dynamically resolve environment variables CodeQL #754: Pull request #1088 opened by zhongxiang117
June 14, 2024 13:14 20m 35s zhongxiang117:master
zhongxiang117:master
June 14, 2024 13:14 20m 35s
Action for reading masses and charges from a PDB file CodeQL #753: Pull request #1087 opened by gtribello
June 14, 2024 08:13 21m 22s read-mass-charge-action
read-mass-charge-action
June 14, 2024 08:13 21m 22s
Action for reading masses and charges from a PDB file CI #2944: Pull request #1087 opened by gtribello
June 14, 2024 08:13 1h 1m 18s read-mass-charge-action
read-mass-charge-action
June 14, 2024 08:13 1h 1m 18s
Fixed manual for MassChangeInput action CI #2943: Commit 24fe95a pushed by gtribello
June 13, 2024 19:46 1h 1m 27s read-mass-charge-action
read-mass-charge-action
June 13, 2024 19:46 1h 1m 27s
Added action that allows you to set the masses and charges from a PDB… CI #2942: Commit b300e57 pushed by gtribello
June 13, 2024 16:53 43m 45s read-mass-charge-action
read-mass-charge-action
June 13, 2024 16:53 43m 45s
Merge branch 'v2.9' CI #2941: Commit 2e07dd1 pushed by carlocamilloni
June 13, 2024 07:40 1h 1m 27s master
master
June 13, 2024 07:40 1h 1m 27s
Merge branch 'v2.9' CodeQL #752: Commit 2e07dd1 pushed by carlocamilloni
June 13, 2024 07:40 22m 45s master
master
June 13, 2024 07:40 22m 45s
changes CI #2940: Commit 5273edf pushed by carlocamilloni
June 13, 2024 07:39 45m 53s v2.9
v2.9
June 13, 2024 07:39 45m 53s
gmx2024 config added more docs CI #2939: Commit 4557203 pushed by carlocamilloni
June 13, 2024 07:37 46m 36s v2.9
v2.9
June 13, 2024 07:37 46m 36s
Ran astyle CI #2938: Commit 3c15aa7 pushed by gtribello
June 13, 2024 06:58 1h 2m 53s master
master
June 13, 2024 06:58 1h 2m 53s
Ran astyle CodeQL #751: Commit 3c15aa7 pushed by gtribello
June 13, 2024 06:58 23m 22s master
master
June 13, 2024 06:58 23m 22s
Ran astyle CI #2937: Commit 3c15aa7 pushed by gtribello
June 12, 2024 17:12 1h 5m 9s fix-gromacs-energy
fix-gromacs-energy
June 12, 2024 17:12 1h 5m 9s
Moved code for ensuring single precision timestep is correctly conver… CI #2936: Commit 8cf7738 pushed by gtribello
June 12, 2024 17:12 1h 2m 42s fix-gromacs-energy
fix-gromacs-energy
June 12, 2024 17:12 1h 2m 42s
Interface to metatensor to use arbitrary machine learning models as collective variables CodeQL #750: Pull request #1082 synchronize by Luthaf
June 12, 2024 13:34 16m 19s lab-cosmo:action-metatensor
lab-cosmo:action-metatensor
June 12, 2024 13:34 16m 19s
Interface to metatensor to use arbitrary machine learning models as collective variables CI #2935: Pull request #1082 synchronize by Luthaf
June 12, 2024 13:34 1h 2m 10s lab-cosmo:action-metatensor
lab-cosmo:action-metatensor
June 12, 2024 13:34 1h 2m 10s
removed unneeded patch files CI #2934: Commit 6707f5f pushed by carlocamilloni
June 12, 2024 08:57 1h 0m 58s master
master
June 12, 2024 08:57 1h 0m 58s
removed unneeded patch files CodeQL #749: Commit 6707f5f pushed by carlocamilloni
June 12, 2024 08:57 23m 35s master
master
June 12, 2024 08:57 23m 35s
clean CI #2933: Commit 8d47e25 pushed by carlocamilloni
June 12, 2024 08:56 1h 1m 39s master
master
June 12, 2024 08:56 1h 1m 39s
clean CodeQL #748: Commit 8d47e25 pushed by carlocamilloni
June 12, 2024 08:56 23m 26s master
master
June 12, 2024 08:56 23m 26s
removed unneeded files CI #2932: Commit faa49bd pushed by carlocamilloni
June 12, 2024 08:53 46m 59s v2.9
v2.9
June 12, 2024 08:53 46m 59s
updated gromacs 2023 patch CI #2931: Commit d52eb23 pushed by carlocamilloni
June 12, 2024 08:45 48m 50s v2.9
v2.9
June 12, 2024 08:45 48m 50s