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nomad-coe / nomad-simulations
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LAST BUILD BRANCH: sprint-dft-qchem
DEFAULT BRANCH: develop
Repo Added 04 Jun 2024 10:07AM UTC
Token 5OmvjqxVQJnqUHvN964EvFffLgPQZapet regen
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LAST BUILD ON BRANCH 113-add-force-field-schema
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  • 100-different-structure-classes
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18 Aug 2025 08:49AM UTC coverage: 72.337%. First build
17035764186

Pull #114

github

JFRudzinski
fixed consistency checks in FF with np.abs()
Pull Request #114: added previous ff schema from older version

320 of 386 new or added lines in 2 files covered. (82.9%)

2390 of 3304 relevant lines covered (72.34%)

0.72 hits per line

Relevant lines Covered
Build:
Build:
3304 RELEVANT LINES 2390 COVERED LINES
0.72 HITS PER LINE
Source Files on 113-add-force-field-schema
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  • List 37
  • Changed 0
  • Source Changed 0
  • Coverage Changed 0
Coverage ∆ File Lines Relevant Covered Missed Hits/Line

Recent builds

Builds Branch Commit Type Ran Committer Via Coverage
17035764186 113-add-force-field-schema fixed consistency checks in FF with np.abs() Pull #114 18 Aug 2025 08:50AM UTC JFRudzinski github
72.34
16991183428 113-add-force-field-schema fix logger_+ ruff Pull #114 15 Aug 2025 01:39PM UTC JFRudzinski github
72.3
16989602149 113-add-force-field-schema ruff Pull #114 15 Aug 2025 12:06PM UTC JFRudzinski github
72.19
16989335926 113-add-force-field-schema ruff format Pull #114 15 Aug 2025 11:48AM UTC JFRudzinski github
70.7
16988311435 113-add-force-field-schema fixed angle-dih format again Pull #114 15 Aug 2025 10:39AM UTC JFRudzinski github
70.7
16987953016 113-add-force-field-schema ruff format Pull #114 15 Aug 2025 10:15AM UTC JFRudzinski github
70.7
16984843773 113-add-force-field-schema ruff format Pull #114 15 Aug 2025 06:58AM UTC JFRudzinski github
70.72
16984840215 113-add-force-field-schema missing np array push 15 Aug 2025 06:58AM UTC JFRudzinski github
70.72
16984571985 113-add-force-field-schema ruff Pull #114 15 Aug 2025 06:39AM UTC JFRudzinski github
70.72
16984400492 113-add-force-field-schema ruff Pull #114 15 Aug 2025 06:26AM UTC JFRudzinski github
70.72
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