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PolyatomicComplexes
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Complexity
Churn
Issues
A
polyatomic_complexes\src\complexes\core_utils.py
30 1 -
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polyatomic_complexes\experiments\experiment_runner.py
20 2 -
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polyatomic_complexes\src\complexes\general_utils.py
29 3 1
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.github\workflows\ci.yml
 39 -
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polyatomic_complexes\src\complexes\polyatomic_complex_cls.py
0 1 -
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polyatomic_complexes\experiments\kernels.py
5 2 -
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polyatomic_complexes\src\complexes\polyatomic_geometry.py
11 2 1
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polyatomic_complexes\src\complexes\space_utils.py
39 3 2
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polyatomic_complexes\experiments\metrics.py
1 2 -
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polyatomic_complexes\src\experiment\process_esol.py
8 1 -
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.github\workflows\joss-compile.yml
 1 -
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polyatomic_complexes\src\experiment\process_lipophilicity.py
8 1 -
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polyatomic_complexes\src\__init__.py
 1 -
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polyatomic_complexes\src\experiment\process_mp_jdft2d.py
6 1 -
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.github\workflows\build_graph.yml
 1 -
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polyatomic_complexes\src\complexes\quantum_complex.py
43 2 1
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polyatomic_complexes\src\complexes\abstract_complex.py
51 3 3
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.github\ISSUE_TEMPLATE\reviewer_feedback.yml
 1 -
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.github\workflows\build.yml
 1 -
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.github\workflows\documentation.yml
 1 -