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refactor geometry optimization (part 1) CI #1403: Pull request #947 synchronize by Albkat
January 22, 2024 18:11 4m 50s Albkat:TS
Albkat:TS
January 22, 2024 18:11 4m 50s
mindless benchmark fix uhf CI #1402: Pull request #953 opened by Albkat
January 22, 2024 15:32 7m 37s Albkat:fix
Albkat:fix
January 22, 2024 15:32 7m 37s
constrain all atoms CI #1401: Pull request #928 synchronize by Albkat
January 22, 2024 15:19 7m 40s Albkat:main
Albkat:main
January 22, 2024 15:19 7m 40s
Fix constraints for aISS docking CI #1400: Pull request #931 synchronize by cplett
January 19, 2024 12:34 6m 39s cplett:aISS
cplett:aISS
January 19, 2024 12:34 6m 39s
add description of xtbtopo.mol CI #1399: Pull request #951 opened by Albkat
January 17, 2024 16:13 6m 48s issue950
issue950
January 17, 2024 16:13 6m 48s
add description of xtbtopo.mol CI #1398: Commit 391daf2 pushed by Albkat
January 17, 2024 16:12 7m 5s issue950
issue950
January 17, 2024 16:12 7m 5s
fix preprocessor definitions (#946) CI #1397: Commit 0fb151d pushed by Albkat
January 17, 2024 16:00 7m 8s issue950
issue950
January 17, 2024 16:00 7m 8s
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