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PolyatomicComplexes
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Name
Complexity
Churn
Issues
A
polyatomic_complexes\src\experiment\process_esol.py
17 1 -
A
.github\dependabot.yml
 1 -
A
polyatomic_complexes\src\experiment\__init__.py
 1 -
A
polyatomic_complexes\src\complexes\building_blocks.py
14 1 -
A
polyatomic_complexes\src\complexes\polyatomic_complex_cls.py
13 1 -
A
polyatomic_complexes\src\experiment\process_lipophilicity.py
17 1 -
A
polyatomic_complexes\src\complexes\space_utils.py
69 1 2
A
polyatomic_complexes\src\experiment\process_photoswitches.py
17 1 -
A
polyatomic_complexes\experiments\kernels.py
12 1 -
A
polyatomic_complexes\src\complexes\polyatomic_geometry.py
14 1 1
A
polyatomic_complexes\experiments\metrics.py
3 1 -
A
polyatomic_complexes\src\complexes\abstract_complex.py
53 1 -
A
polyatomic_complexes\src\experiment\process_freesolv.py
17 1 -
A
polyatomic_complexes\src\complexes\core_utils.py
59 1 -
A
polyatomic_complexes\src\experiment\process_materials_project.py
10 1 -
B
polyatomic_complexes\tests\test_geom.py
70 1 5
A
polyatomic_complexes\src\experiment\process_mp_jdft2d.py
13 1 -
A
polyatomic_complexes\src\complexes\force_complex.py
30 1 -
A
polyatomic_complexes\experiments\__init__.py
 1 -
A
polyatomic_complexes\src\__init__.py
 2 -