Skip to content

Actions: grimme-lab/xtb

Actions

CI

Actions

Loading...
Loading

Show workflow options

Create status badge

Loading
fortran-build.yml
244 workflow run results
244 workflow run results

Filter by Event

Filter by Status

Filter by Branch

Filter by Actor

add embd to SCC energy CI #1345: Pull request #891 opened by Albkat
October 30, 2023 17:10 16m 20s Albkat:embd
Albkat:embd
October 30, 2023 17:10 16m 20s
accuracy parameter in variable declaration missing (#882) CI #1344: Commit 82e5569 pushed by marcelmbn
October 6, 2023 12:56 14m 47s main
main
October 6, 2023 12:56 14m 47s
accuracy parameter in variable declaration missing CI #1343: Pull request #882 opened by marcelmbn
October 6, 2023 12:37 12m 54s marcelmbn:main
marcelmbn:main
October 6, 2023 12:37 12m 54s
Dimer Projection Method DIPRO for xtb (#856) CI #1342: Commit 0813880 pushed by MtoLStoN
October 5, 2023 13:03 14m 32s main
main
October 5, 2023 13:03 14m 32s
Dimer Projection Method DIPRO for xtb CI #1341: Pull request #856 synchronize by MtoLStoN
October 5, 2023 12:32 16m 12s demonic-daisy:master
demonic-daisy:master
October 5, 2023 12:32 16m 12s
Dimer Projection Method DIPRO for xtb CI #1340: Pull request #856 synchronize by MtoLStoN
October 5, 2023 12:30 17m 56s demonic-daisy:master
demonic-daisy:master
October 5, 2023 12:30 17m 56s
Dimer Projection Method DIPRO for xtb CI #1339: Pull request #856 synchronize by MtoLStoN
October 5, 2023 12:29 13m 54s demonic-daisy:master
demonic-daisy:master
October 5, 2023 12:29 13m 54s
Dimer Projection Method DIPRO for xtb CI #1338: Pull request #856 synchronize by MtoLStoN
October 5, 2023 12:28 15m 43s demonic-daisy:master
demonic-daisy:master
October 5, 2023 12:28 15m 43s
Fix manual override of charge for pdb files. (#881) CI #1337: Commit d140d40 pushed by MtoLStoN
October 4, 2023 16:48 15m 51s main
main
October 4, 2023 16:48 15m 51s
Fix manual override of charge for pdb files. CI #1336: Pull request #881 synchronize by MtoLStoN
October 4, 2023 16:32 16m 11s MtoLStoN:gfnff_pdb
MtoLStoN:gfnff_pdb
October 4, 2023 16:32 16m 11s
Fix manual override of charge for pdb files. CI #1335: Pull request #881 synchronize by MtoLStoN
October 4, 2023 16:28 12m 22s MtoLStoN:gfnff_pdb
MtoLStoN:gfnff_pdb
October 4, 2023 16:28 12m 22s
Fix manual override of charge for pdb files. CI #1334: Pull request #881 opened by MtoLStoN
October 4, 2023 16:22 12m 47s MtoLStoN:gfnff_pdb
MtoLStoN:gfnff_pdb
October 4, 2023 16:22 12m 47s
Dimer Projection Method DIPRO for xtb CI #1333: Pull request #856 synchronize by MtoLStoN
October 4, 2023 11:48 13m 39s demonic-daisy:master
demonic-daisy:master
October 4, 2023 11:48 13m 39s
Dimer Projection Method DIPRO for xtb CI #1332: Pull request #856 synchronize by demonic-daisy
October 4, 2023 10:33 13m 47s demonic-daisy:master
demonic-daisy:master
October 4, 2023 10:33 13m 47s
Dimer Projection Method DIPRO for xtb CI #1331: Pull request #856 synchronize by demonic-daisy
October 4, 2023 10:32 6m 4s demonic-daisy:master
demonic-daisy:master
October 4, 2023 10:32 6m 4s
Dimer Projection Method DIPRO for xtb CI #1330: Pull request #856 synchronize by demonic-daisy
October 4, 2023 10:31 12m 7s demonic-daisy:master
demonic-daisy:master
October 4, 2023 10:31 12m 7s
Dimer Projection Method DIPRO for xtb CI #1329: Pull request #856 synchronize by demonic-daisy
October 4, 2023 10:28 13m 2s demonic-daisy:master
demonic-daisy:master
October 4, 2023 10:28 13m 2s
Dimer Projection Method DIPRO for xtb CI #1328: Pull request #856 synchronize by demonic-daisy
October 4, 2023 10:27 18m 6s demonic-daisy:master
demonic-daisy:master
October 4, 2023 10:27 18m 6s
Update URL to docs in README.md (#873) CI #1327: Commit b15c487 pushed by MtoLStoN
September 22, 2023 15:36 13m 57s main
main
September 22, 2023 15:36 13m 57s
Update URL to docs in README.md CI #1326: Pull request #873 opened by chem-william
September 22, 2023 08:30 5m 8s chem-william:main
chem-william:main
September 22, 2023 08:30 5m 8s
Introducing a scaling factor for directed docking (#868) CI #1325: Commit c31a1ca pushed by cplett
September 21, 2023 14:31 14m 51s main
main
September 21, 2023 14:31 14m 51s
Introducing a scaling factor for directed docking CI #1324: Pull request #868 synchronize by MtoLStoN
September 21, 2023 14:19 13m 28s cplett:directed_aISS
cplett:directed_aISS
September 21, 2023 14:19 13m 28s
Add "--tmcosmo" mode for writing .cosmo files with TM convention. (#864) CI #1323: Commit 9e67d6e pushed by MtoLStoN
September 20, 2023 13:55 13m 56s main
main
September 20, 2023 13:55 13m 56s
Add "--tmcosmo" mode for writing .cosmo files with TM convention. CI #1322: Pull request #864 synchronize by MtoLStoN
September 20, 2023 11:23 16m 33s MtoLStoN:tmcosmo
MtoLStoN:tmcosmo
September 20, 2023 11:23 16m 33s
Add "--tmcosmo" mode for writing .cosmo files with TM convention. CI #1321: Pull request #864 synchronize by Albkat
September 20, 2023 09:43 13m 31s MtoLStoN:tmcosmo
MtoLStoN:tmcosmo
September 20, 2023 09:43 13m 31s