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nomad-coe / atomistic-parsers / 9583225563

Builds Branch Commit Type Ran Committer Via Coverage
9583225563 109-test-issue Fix quantity types (#106) * Fix amber * Fix asap * Fix bopfox * Fix dftbplus * Fix dlpoly * Fix gromos * Fix gulp * Fix h5md * Fix libatoms * Fix namd * Fix tinker * Fix xtb * Fix gromacs * Fix lammps * M... push 19 Jun 2024 02:00PM UTC web-flow github
88.17
9582099619 108-add-support-for-mole-in-energy-quantities-in-h5md-parser Fix quantity types (#106) * Fix amber * Fix asap * Fix bopfox * Fix dftbplus * Fix dlpoly * Fix gromos * Fix gulp * Fix h5md * Fix libatoms * Fix namd * Fix tinker * Fix xtb * Fix gromacs * Fix lammps * M... push 19 Jun 2024 12:44PM UTC web-flow github
88.17
9112725076 develop Fix quantity types (#106) * Fix amber * Fix asap * Fix bopfox * Fix dftbplus * Fix dlpoly * Fix gromos * Fix gulp * Fix h5md * Fix libatoms * Fix namd * Fix tinker * Fix xtb * Fix gromacs * Fix lammps * M... push 16 May 2024 01:07PM UTC web-flow github
88.17
9111179626 fix-quantity-types Merge pull request #107 from nomad-coe/fix-interactions Fix interactions Pull #106 16 May 2024 11:15AM UTC web-flow github
88.17
9109889242 fix-interactions fix for inhomogeneous labels Pull #107 16 May 2024 09:37AM UTC jrudz github
88.17
9096958082 fix-interactions removed prints push 15 May 2024 02:03PM UTC jrudz github
88.22
9096940543 fix-interactions resolved indexing issues push 15 May 2024 02:01PM UTC jrudz github
88.22
8830505722 fix-quantity-types Linting fix Pull #106 25 Apr 2024 10:00AM UTC ladinesa github
88.19
8751893048 develop Update writing of hdf5 data (#105) * Update writing of hdf5 data * Fix gh actions * Fix test push 19 Apr 2024 10:16AM UTC web-flow github
88.2
8751705030 update-hdf5 Fix test Pull #105 19 Apr 2024 10:00AM UTC ladinesa github
88.2
8438275643 develop Merge pull request #101 from nomad-coe/100-errors-from-pyiron-lammps-log fixed regex to skip lines in log with variables push 26 Mar 2024 03:16PM UTC web-flow github
88.16
8437850882 100-errors-from-pyiron-lammps-log removed if statement in str to op Pull #101 26 Mar 2024 02:46PM UTC jrudz github
88.16
8437804766 100-errors-from-pyiron-lammps-log fixed regex to skip lines in log with variables push 26 Mar 2024 02:44PM UTC jrudz github
88.15
8436889371 100-errors-from-pyiron-lammps-log Fix nomad dependency (#99) push 26 Mar 2024 01:43PM UTC web-flow github
88.19
8263413468 develop Fix nomad dependency (#99) push 13 Mar 2024 11:01AM UTC web-flow github
88.19
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