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Fix barostat frequency passing
mypy #2294: Pull request #669 synchronize by IAlibay
January 9, 2024 12:48 4m 35s barostat_frequency
January 9, 2024 12:48 4m 35s
Adding LambdaSettings object for AFE
mypy #2293: Pull request #681 synchronize by hannahbaumann
January 8, 2024 13:09 1m 7s lambda_settings_afe
January 8, 2024 13:09 1m 7s
Adding LambdaSettings object for AFE
mypy #2292: Pull request #681 synchronize by hannahbaumann
January 8, 2024 12:37 1m 5s lambda_settings_afe
January 8, 2024 12:37 1m 5s
Adding LambdaSettings object for AFE
mypy #2291: Pull request #681 synchronize by hannahbaumann
January 8, 2024 12:22 1m 20s lambda_settings_afe
January 8, 2024 12:22 1m 20s
Adding LambdaSettings object for AFE
mypy #2290: Pull request #681 opened by hannahbaumann
January 8, 2024 09:46 4m 35s lambda_settings_afe
January 8, 2024 09:46 4m 35s
Properly set the cutoff distance in HTF nonbonded forces
mypy #2289: Pull request #675 synchronize by IAlibay
January 5, 2024 14:06 4m 37s cutoff-fix
January 5, 2024 14:06 4m 37s
Expand water virtual site tests
mypy #2288: Pull request #680 synchronize by IAlibay
January 5, 2024 03:24 1m 13s env-vs
January 5, 2024 03:24 1m 13s
Expand water virtual site tests
mypy #2287: Pull request #680 synchronize by IAlibay
January 5, 2024 03:22 1m 14s env-vs
January 5, 2024 03:22 1m 14s
Expand water virtual site tests
mypy #2286: Pull request #680 opened by IAlibay
January 5, 2024 02:41 6m 48s env-vs
January 5, 2024 02:41 6m 48s
Merge pull request #676 from OpenFreeEnergy/fix/conda_env_cache
mypy #2285: Commit b1a7c06 pushed by IAlibay
January 3, 2024 14:07 6m 49s main
January 3, 2024 14:07 6m 49s
Set cache to expire after a day
mypy #2284: Pull request #676 opened by mikemhenry
January 2, 2024 22:38 6m 47s fix/conda_env_cache
January 2, 2024 22:38 6m 47s
Properly set the cutoff distance in HTF nonbonded forces
mypy #2283: Pull request #675 synchronize by IAlibay
January 1, 2024 18:43 1m 13s cutoff-fix
January 1, 2024 18:43 1m 13s
Properly set the cutoff distance in HTF nonbonded forces
mypy #2282: Pull request #675 opened by IAlibay
January 1, 2024 18:40 2m 41s cutoff-fix
January 1, 2024 18:40 2m 41s
OpenMMSolvation: Support for non-cubic boxes and defined box properties
mypy #2280: Pull request #673 opened by IAlibay
December 29, 2023 23:18 4m 39s noncubic-solvent
December 29, 2023 23:18 4m 39s
Merge pull request #516 from OpenFreeEnergy/plain_md
mypy #2279: Commit 5a2c339 pushed by IAlibay
December 28, 2023 16:21 58s main
December 28, 2023 16:21 58s
Protocol to run plain MD simulations
mypy #2278: Pull request #516 synchronize by IAlibay
December 28, 2023 00:03 59s plain_md
December 28, 2023 00:03 59s
Fix barostat frequency passing
mypy #2277: Pull request #669 synchronize by IAlibay
December 24, 2023 23:33 59s barostat_frequency
December 24, 2023 23:33 59s
Fix barostat frequency passing
mypy #2276: Pull request #669 synchronize by IAlibay
December 24, 2023 23:31 1m 11s barostat_frequency
December 24, 2023 23:31 1m 11s
Fix barostat frequency passing
mypy #2275: Pull request #669 opened by IAlibay
December 24, 2023 23:15 1m 5s barostat_frequency
December 24, 2023 23:15 1m 5s
Fix sing file installer (#667)
mypy #2274: Commit 2213b71 pushed by mikemhenry
December 19, 2023 16:24 6m 43s main
December 19, 2023 16:24 6m 43s
Fix sing file installer
mypy #2273: Pull request #667 opened by mikemhenry
December 19, 2023 16:13 6m 46s fix/single_file_installer_remove_cache
December 19, 2023 16:13 6m 46s
consequences of gufe #260 change
mypy #2272: Pull request #666 opened by richardjgowers
December 18, 2023 18:02 1m 0s gufe_260_consequences
December 18, 2023 18:02 1m 0s
Issue 335 float quantity in settings (#657)
mypy #2271: Commit a3b5305 pushed by richardjgowers
December 18, 2023 16:29 7m 10s main
December 18, 2023 16:29 7m 10s
Protocol to run plain MD simulations
mypy #2270: Pull request #516 synchronize by hannahbaumann
December 13, 2023 14:53 7m 9s plain_md
December 13, 2023 14:53 7m 9s
Issue 335 float quantity in settings
mypy #2269: Pull request #657 synchronize by mikemhenry
December 12, 2023 18:43 4m 31s issue_335_FloatQuantity_in_settings
December 12, 2023 18:43 4m 31s