anandojha/PySTARC

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PySTARC

Grade	Name	Complexity	Churn	Issues
F	examples\hsp90_inhibitors\HSP90-resorcinol\setup.py	159	2	80
F	examples\beta_cyclodextrin_guests\BCD_aspirin\setup.py	159	8	80
F	examples\p38_mapk_sb203580\setup.py	159	8	80
F	examples\hsp90_inhibitors\HSP90-aminopyridine\setup.py	159	2	80
F	examples\hsp90_inhibitors\HSP90-indazole_5LNZ\setup.py	159	1	80
F	examples\carbonic_anhydrase_inhibitors\ca1_vd1269\setup.py	159	9	80
F	examples\beta_cyclodextrin_guests\BCD_methyl_butyrate\setup.py	159	8	80
F	examples\trypsin_benzamidine\setup.py	159	10	80
F	examples\carbonic_anhydrase_inhibitors\ca2_vd1142\setup.py	159	9	80
F	examples\carbonic_anhydrase_inhibitors\ca13_vd1126\setup.py	159	9	80
C	examples\barnase_barstar\setup.py	43	3	32
F	tests\test_pystarc.py	337	52	12
A	pystarc\pipeline\geometry.py	60	14	4
A	pystarc\simulation\coffdrop_params.py	46	6	4
A	pystarc\simulation\chain_simulator.py	134	9	4
A	pystarc\pipeline\input_parser.py	45	14	2
A	pystarc\multi_GPU\multi_GPU_runs.py	15	5	2
A	pystarc\pipeline\prepare_bd_surface.py	64	14	2
A	pystarc\pipeline\pipeline.py	40	15	2
A	pystarc\multi_GPU\combine_data.py	95	12	2