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PySTARC
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Grade
Name
Complexity
Churn
Issues
A
examples\carbonic_anhydrase_inhibitors\ca2_vd1142\run.sh
 3 -
F
examples\ttk_inhibitors\5N93\setup.py
159 3 80
A
examples\two_charged_spheres\analytical.py
2 4 -
A
pystarc\transforms\quaternion.py
10 4 -
A
requirements.txt
 4 -
A
pystarc\motion\adaptive_time_step.py
13 4 -
A
pystarc\forces\multipole.py
11 4 1
A
pystarc\simulation\diffusional_rotation.py
9 4 -
A
.github\workflows\ci.yml
 4 -
A
pystarc\pipeline\chain_output_writer.py
83 4 1
A
examples\two_charged_spheres\convergence.py
0 5 -
A
examples\two_charged_spheres\run.sh
 5 -
A
pystarc\simulation\step_near_surface.py
16 5 -
A
pystarc\pipeline\parameterize.py
6 5 -
A
pystarc\multi_GPU\multi_GPU_runs.py
15 5 2
A
pystarc\forces\multipole_farfield.py
13 5 -
A
pystarc\molsystem\system_state.py
0 5 -
A
pystarc\lib\numerical.py
10 5 -
A
pystarc\simulation\coffdrop_params.py
46 6 4
A
pystarc\pipeline\output_writer.py
53 6 1