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PySTARC
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Name
Complexity
Churn
Issues
A
examples\trypsin_benzamidine_multi_GPUs\submit_SLURM_single_GPU.sh
 1 2
A
examples\barnase_barstar_chainbd\submit_SLURM_chain_bd.sh
 1 -
A
examples\ttk_inhibitors\run.sh
 1 2
A
examples\beta_cyclodextrin_guests\run.sh
 1 2
A
pystarc\forces\electrostatic\grid_force.py
19 8 -
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pystarc\cli\main.py
22 6 -
A
.codecov.yml
 1 -
A
pystarc\forces\lj.py
12 8 -
A
examples\carbonic_anhydrase_inhibitors\ca13_vd1125\run.sh
 2 2
A
pystarc\forces\multipole.py
11 4 1
A
examples\p38_mapk_sb203580\run.sh
 1 2
A
examples\two_charged_spheres\run.sh
 3 1
A
examples\thrombin_thrombomodulin\bb_effect.py
8 2 -
A
pystarc\forces\multipole_farfield.py
13 5 -
A
pystarc\hydrodynamics\rotne_prager.py
38 9 -
A
pystarc\hydrodynamics\mc_hydro_radius.py
16 3 -
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pystarc\forces\gpu_batch_engine.py
54 13 -
A
pystarc\forces\engine.py
59 7 2
A
examples\two_charged_spheres\analytical.py
2 2 -
A
examples\carbonic_anhydrase_inhibitors\ca13_azm\run.sh
 2 2