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Add option to select solvent model to the C-API (#1068)
CI #1565: Commit bdc305f pushed by marcelmbn
September 9, 2024 14:10 10m 45s main
September 9, 2024 14:10 10m 45s
Add Hessian to C-api
CI #1564: Pull request #1071 synchronize by TyBalduf
September 5, 2024 14:01 8m 26s TyBalduf:hessian_api
September 5, 2024 14:01 8m 26s
aISS update (#1089)
CI #1561: Commit 7662ad3 pushed by marcelmbn
September 2, 2024 10:41 10m 27s main
September 2, 2024 10:41 10m 27s
aISS update
CI #1560: Pull request #1089 synchronize by cplett
August 29, 2024 08:05 8m 28s cplett:aISS_update
August 29, 2024 08:05 8m 28s
aISS update
CI #1559: Pull request #1089 synchronize by cplett
August 21, 2024 11:14 8m 43s cplett:aISS_update
August 21, 2024 11:14 8m 43s
aISS update
CI #1558: Pull request #1089 synchronize by cplett
August 21, 2024 07:52 1h 3m 27s cplett:aISS_update
August 21, 2024 07:52 1h 3m 27s
aISS update
CI #1557: Pull request #1089 opened by cplett
August 19, 2024 14:41 8m 39s cplett:aISS_update
August 19, 2024 14:41 8m 39s
remove GCC-11 from macOS as it got removed from the images (#1088)
CI #1556: Commit 043d587 pushed by marcelmbn
August 14, 2024 15:18 17m 39s main
August 14, 2024 15:18 17m 39s
Update GitHub workflow to latest state (#1087)
CI #1554: Commit f7eb690 pushed by marcelmbn
August 14, 2024 11:40 22s main
August 14, 2024 11:40 22s
Update GitHub workflow to latest state
CI #1553: Pull request #1087 synchronize by marcelmbn
August 14, 2024 09:42 5m 33s marcelmbn:fix/CI_workflow
August 14, 2024 09:42 5m 33s
Update GitHub workflow to latest state
CI #1552: Pull request #1087 synchronize by marcelmbn
August 14, 2024 09:33 9m 42s marcelmbn:fix/CI_workflow
August 14, 2024 09:33 9m 42s
Update GitHub workflow to latest state
CI #1551: Pull request #1087 opened by marcelmbn
August 14, 2024 09:14 8m 39s marcelmbn:fix/CI_workflow
August 14, 2024 09:14 8m 39s
Make DFTD4 & multicharge dependencies optional (#1081)
CI #1550: Commit a3d5c5e pushed by marcelmbn
August 12, 2024 21:16 35s main
August 12, 2024 21:16 35s
fix dftd4 tests by updating to more recent version (#1085)
CI #1549: Commit 5800488 pushed by marcelmbn
August 12, 2024 21:10 9m 25s main
August 12, 2024 21:10 9m 25s
August 9, 2024 20:53 5m 23s
Detect ifx (intel-llvm) when determining compiler settings (#1060)
CI #1546: Commit e280465 pushed by marcelmbn
August 9, 2024 20:51 11m 30s main
August 9, 2024 20:51 11m 30s
Add explanation for translation entropy constants
CI #1545: Pull request #1077 synchronize by marcelmbn
August 9, 2024 07:38 7m 34s TyBalduf:constants
August 9, 2024 07:38 7m 34s
Make DFTD4 & multicharge dependencies optional
CI #1544: Pull request #1081 synchronize by TyBalduf
August 9, 2024 02:53 9m 29s TyBalduf:optional_deps
August 9, 2024 02:53 9m 29s
Make DFTD4 & multicharge dependencies optional
CI #1543: Pull request #1081 synchronize by TyBalduf
August 9, 2024 02:49 8m 30s TyBalduf:optional_deps
August 9, 2024 02:49 8m 30s
Add Hessian to C-api
CI #1541: Pull request #1071 synchronize by TyBalduf
August 8, 2024 17:30 36s TyBalduf:hessian_api
August 8, 2024 17:30 36s