Fix compute_struct_fingerprints.py: cannot insert material_id, already exists
#31
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…y exists (closes #30)
pep8-naming pandas-vet flakes8-pyi flake8-return
E AssertionError: assert ['MEGNet', 'C... 'Voronoi RF'] == ['MEGNet', 'C...RF', 'metric'] E Right contains one more item: 'metric' E Full diff: E - ['MEGNet', 'CGCNN', 'Voronoi RF', 'metric'] E ? ---------- E + ['MEGNet', 'CGCNN', 'Voronoi RF']
janosh
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…ready exists (#31) * fix compute_struct_fingerprints.py: cannot insert material_id, already exists (closes #30) * add ruff rule sets pep8-naming pandas-vet flakes8-pyi flake8-return * add rows=2 x cols=4 version of each-scatter-models * add rows=2 x cols=4 version of hist-clf-(pred|true)-hull-dist-models * fix CI assert list(df_metrics) == [*models, "metric"] E AssertionError: assert ['MEGNet', 'C... 'Voronoi RF'] == ['MEGNet', 'C...RF', 'metric'] E Right contains one more item: 'metric' E Full diff: E - ['MEGNet', 'CGCNN', 'Voronoi RF', 'metric'] E ? ---------- E + ['MEGNet', 'CGCNN', 'Voronoi RF']
janosh
added a commit
that referenced
this pull request
Jun 20, 2023
…ready exists (#31) * fix compute_struct_fingerprints.py: cannot insert material_id, already exists (closes #30) * add ruff rule sets pep8-naming pandas-vet flakes8-pyi flake8-return * add rows=2 x cols=4 version of each-scatter-models * add rows=2 x cols=4 version of hist-clf-(pred|true)-hull-dist-models * fix CI assert list(df_metrics) == [*models, "metric"] E AssertionError: assert ['MEGNet', 'C... 'Voronoi RF'] == ['MEGNet', 'C...RF', 'metric'] E Right contains one more item: 'metric' E Full diff: E - ['MEGNet', 'CGCNN', 'Voronoi RF', 'metric'] E ? ---------- E + ['MEGNet', 'CGCNN', 'Voronoi RF']
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c5eda47 fix compute_struct_fingerprints.py: cannot insert material_id, already exists (closes #30)
a7a1bb1 add ruff rule sets
10d06f7 add rows=2 x cols=4 version of each-scatter-models
a811f95 add rows=2 x cols=4 version of hist-clf-(pred|true)-hull-dist-models
fe1ae67 fix CI assert list(df_metrics) == [*models, "metric"]