anandojha/PySTARC

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PySTARC

Grade	Name	Complexity	Churn	Issues
F	examples\hsp90_inhibitors\HSP90-indazole_5LNZ\setup.py	159	1	80
F	examples\beta_cyclodextrin_guests\BCD_aspirin\setup.py	159	8	80
F	examples\hsp90_inhibitors\HSP90-quinazoline\setup.py	159	2	80
F	examples\carbonic_anhydrase_inhibitors\ca13_vd1209\setup.py	159	9	80
F	examples\carbonic_anhydrase_inhibitors\ca13_vd1126\setup.py	159	9	80
F	examples\beta_cyclodextrin_guests\BCD_1-naphthylethanol\setup.py	159	8	80
F	examples\ttk_inhibitors\5NAD\setup.py	159	3	80
F	examples\hsp90_inhibitors\HSP90-resorcinol\setup.py	159	2	80
F	examples\beta_cyclodextrin_guests\BCD_tertbutanol\setup.py	159	8	80
F	examples\ttk_inhibitors\5LJJ\setup.py	159	3	80
F	examples\beta_cyclodextrin_guests\BCD_methyl_butyrate\setup.py	159	8	80
F	examples\carbonic_anhydrase_inhibitors\ca13_vd1269\setup.py	159	9	80
F	examples\carbonic_anhydrase_inhibitors\ca13_vd1125\setup.py	159	9	80
A	pystarc\simulation\chain_simulator.py	134	9	4
A	pystarc\multi_GPU\combine_data.py	95	12	2
A	pystarc\pipeline\chain_output_writer.py	83	4	1
A	pystarc\simulation\outer_propagator.py	64	10	1
A	pystarc\pipeline\prepare_bd_surface.py	64	14	2
A	pystarc\structures\chain_io.py	63	7	2
A	pystarc\pipeline\geometry.py	60	14	4