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Merge pull request #1122 from openforcefield/cache-parameter-lookups ci #4167: Commit b623003 pushed by mattwthompson
January 16, 2025 15:04 15m 24s main
main
January 16, 2025 15:04 15m 24s
Improve performance of Interchange.from_smirnoff on polymers ci #4166: Pull request #1122 synchronize by mattwthompson
January 16, 2025 14:44 14m 11s cache-parameter-lookups
cache-parameter-lookups
January 16, 2025 14:44 14m 11s
ci ci #4165: Scheduled
January 16, 2025 05:03 13m 27s main
main
January 16, 2025 05:03 13m 27s
Read GROMACS topology files split into .itp files ci #4164: Pull request #1120 synchronize by mattwthompson
January 15, 2025 20:14 20m 39s read-itp
read-itp
January 15, 2025 20:14 20m 39s
Cache some charge increment calculations ci #4163: Pull request #1126 synchronize by mattwthompson
January 15, 2025 19:33 24m 49s fix-charge-summing
fix-charge-summing
January 15, 2025 19:33 24m 49s
Cache some charge increment calculations ci #4162: Pull request #1126 synchronize by mattwthompson
January 15, 2025 18:30 16m 30s fix-charge-summing
fix-charge-summing
January 15, 2025 18:30 16m 30s
Merge pull request #1115 from openforcefield/use-charge-caching ci #4161: Commit 9460db5 pushed by mattwthompson
January 15, 2025 16:37 1h 20m 25s main
main
January 15, 2025 16:37 1h 20m 25s
More consistently use existing charge caching ci #4160: Pull request #1115 synchronize by mattwthompson
January 15, 2025 14:32 1h 27m 38s use-charge-caching
use-charge-caching
January 15, 2025 14:32 1h 27m 38s
Merge pull request #1118 from openforcefield/more-gromacs-import-tests ci #4159: Commit 6a515c0 pushed by mattwthompson
January 15, 2025 14:09 27m 16s main
main
January 15, 2025 14:09 27m 16s
ci ci #4158: Scheduled
January 15, 2025 05:03 14m 10s main
main
January 15, 2025 05:03 14m 10s
Always use openmm.LangevinMiddleIntegrator ci #4157: Pull request #1137 synchronize by mattwthompson
January 14, 2025 21:42 2h 8m 8s openmm-driver-integrator
openmm-driver-integrator
January 14, 2025 21:42 2h 8m 8s
Improve testing of GROMACS import ci #4156: Pull request #1118 synchronize by mattwthompson
January 14, 2025 20:06 40m 17s more-gromacs-import-tests
more-gromacs-import-tests
January 14, 2025 20:06 40m 17s
Handle OpenMM version parsing in regression tests ci #4155: Pull request #1140 opened by mattwthompson
January 14, 2025 19:53 36m 29s bump-regression-tests
bump-regression-tests
January 14, 2025 19:53 36m 29s
Merge pull request #1138 from openforcefield/pre-commit-ci-update-config ci #4154: Commit e1a99d6 pushed by mattwthompson
January 14, 2025 18:55 24m 46s main
main
January 14, 2025 18:55 24m 46s
ci ci #4153: Scheduled
January 14, 2025 05:03 13m 57s main
main
January 14, 2025 05:03 13m 57s
Add center-of-mass motion remover in OpenMM export ci #4152: Pull request #1133 synchronize by mattwthompson
January 13, 2025 22:10 1h 50m 56s openmm-add-cmmotionremover
openmm-add-cmmotionremover
January 13, 2025 22:10 1h 50m 56s
[pre-commit.ci] pre-commit autoupdate ci #4151: Pull request #1138 synchronize by pre-commit-ci bot
January 13, 2025 20:45 2h 46m 8s pre-commit-ci-update-config
pre-commit-ci-update-config
January 13, 2025 20:45 2h 46m 8s
[pre-commit.ci] pre-commit autoupdate ci #4150: Pull request #1138 opened by pre-commit-ci bot
January 13, 2025 20:45 2h 4m 42s pre-commit-ci-update-config
pre-commit-ci-update-config
January 13, 2025 20:45 2h 4m 42s
Read GROMACS topology files split into .itp files ci #4149: Pull request #1120 synchronize by mattwthompson
January 13, 2025 20:05 1h 14m 28s read-itp
read-itp
January 13, 2025 20:05 1h 14m 28s
Improve testing of GROMACS import ci #4148: Pull request #1118 synchronize by mattwthompson
January 13, 2025 20:00 18m 50s more-gromacs-import-tests
more-gromacs-import-tests
January 13, 2025 20:00 18m 50s
ci ci #4147: Scheduled
January 13, 2025 05:03 15m 10s main
main
January 13, 2025 05:03 15m 10s
ci ci #4146: Scheduled
January 12, 2025 05:03 13m 33s main
main
January 12, 2025 05:03 13m 33s
ci ci #4145: Scheduled
January 11, 2025 05:02 12m 19s main
main
January 11, 2025 05:02 12m 19s
Always use openmm.LangevinMiddleIntegrator ci #4144: Pull request #1137 opened by mattwthompson
January 10, 2025 21:05 20m 30s openmm-driver-integrator
openmm-driver-integrator
January 10, 2025 21:05 20m 30s
Merge pull request #1134 from openforcefield/from-openmm-water-box ci #4143: Commit 271caed pushed by mattwthompson
January 10, 2025 19:33 39m 47s main
main
January 10, 2025 19:33 39m 47s