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PolyatomicComplexes
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Complexity
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Issues
A
polyatomic_complexes\experiments\__init__.py
 1 -
A
.github\dependabot.yml
 1 -
A
polyatomic_complexes\src\complexes\polyatomic_geometry.py
11 1 1
A
polyatomic_complexes\src\complexes\space_utils.py
39 1 2
A
polyatomic_complexes\src\complexes\core_utils.py
30 1 -
A
polyatomic_complexes\experiments\metrics.py
1 1 -
B
polyatomic_complexes\tests\test_geom.py
52 1 5
A
polyatomic_complexes\src\experiment\process.py
8 1 -
A
.github\workflows\documentation.yml
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A
polyatomic_complexes\src\complexes\force_complex.py
12 1 -
A
polyatomic_complexes\src\experiment\__init__.py
 1 -
A
polyatomic_complexes\experiments\kernels.py
5 1 -
A
polyatomic_complexes\src\experiment\process_mp_jdft2d.py
6 1 -
A
polyatomic_complexes\src\experiment\process_materials_project.py
7 1 -
A
polyatomic_complexes\src\complexes\polyatomic_complex_cls.py
0 1 -
A
polyatomic_complexes\src\__init__.py
 2 -
A
polyatomic_complexes\src\experiment\process_freesolv.py
0 2 -
A
polyatomic_complexes\src\experiment\process_esol.py
0 2 -
A
polyatomic_complexes\src\complexes\quantum_complex.py
43 2 1
A
polyatomic_complexes\src\experiment\process_lipophilicity.py
0 2 -