anandojha/PySTARC

main

PySTARC

Grade	Name	Complexity	Churn	Issues
F	tests\test_pystarc.py	242	17	20
F	examples\trypsin_benzamidine\setup.py	9	8	88
A	pystarc\pipeline\input_parser.py	43	8	2
A	pystarc\simulation\gpu_batch_simulator.py	180	8	2
F	examples\beta_cyclodextrin_guests\BCD_2-naphthylethanol\setup.py	9	7	88
F	examples\beta_cyclodextrin_guests\BCD_aspirin\setup.py	9	7	88
F	examples\beta_cyclodextrin_guests\BCD_tertbutanol\setup.py	9	7	88
F	examples\beta_cyclodextrin_guests\BCD_methyl_butyrate\setup.py	9	7	88
F	examples\beta_cyclodextrin_guests\BCD_1-naphthylethanol\setup.py	9	7	88
A	pystarc\pipeline\pipeline.py	40	7	2
F	examples\beta_cyclodextrin_guests\BCD_1-butanol\setup.py	9	7	88
F	examples\beta_cyclodextrin_guests\BCD_1-propanol\setup.py	9	7	88
F	examples\carbonic_anhydrase_inhibitors\ca2_vd1142\setup.py	10	6	107
F	examples\carbonic_anhydrase_inhibitors\ca13_vd1125\setup.py	10	6	107
F	examples\p38_mapk_sb203580\setup.py	10	6	104
F	examples\carbonic_anhydrase_inhibitors\ca13_vd1126\setup.py	10	6	107
A	pystarc\forces\gpu_batch_engine.py	51	6	-
F	examples\carbonic_anhydrase_inhibitors\ca1_vd1269\setup.py	10	6	107
F	examples\carbonic_anhydrase_inhibitors\ca13_vd1209\setup.py	10	6	107
F	examples\carbonic_anhydrase_inhibitors\ca13_vd1269\setup.py	10	6	107