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Set threads for MD, allow ANCOPT threshold definition in input.toml
CI #194: Commit e784258 pushed by pprcht
November 7, 2023 13:54 7m 58s 3.0dev
November 7, 2023 13:54 7m 58s
Set threads for MD, allow ANCOPT threshold definition in input.toml
Close stale issues and PRs #3: Commit e784258 pushed by pprcht
November 7, 2023 13:54 Failure 3.0dev
November 7, 2023 13:54 Failure
Repair tblite subproject build with meson
CI #193: Commit 762fc6d pushed by pprcht
October 2, 2023 15:48 8m 4s 3.0dev
October 2, 2023 15:48 8m 4s
Repair tblite subproject build with meson
Close stale issues and PRs #2: Commit 762fc6d pushed by pprcht
October 2, 2023 15:48 Failure 3.0dev
October 2, 2023 15:48 Failure
Defaults and bug-fixes
CI #192: Commit 62b735c pushed by pprcht
October 2, 2023 13:09 13m 16s 3.0dev
October 2, 2023 13:09 13m 16s
Defaults and bug-fixes
Close stale issues and PRs #1: Commit 62b735c pushed by pprcht
October 2, 2023 13:09 Failure 3.0dev
October 2, 2023 13:09 Failure
Allow QCG site directed solvation (#226)
CI #191: Commit 02da018 pushed by pprcht
September 25, 2023 10:23 6m 21s master
September 25, 2023 10:23 6m 21s
Allow QCG site directed solvation
CI #190: Pull request #226 synchronize by pprcht
September 25, 2023 10:17 5m 30s cplett:QCG_1
September 25, 2023 10:17 5m 30s
Make final GFN2 optimizations in QCG optional (#224)
CI #189: Commit 731611c pushed by pprcht
September 25, 2023 09:48 5m 14s master
September 25, 2023 09:48 5m 14s
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