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FIRECODE
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Grade
Name
Complexity
Churn
Issues
A
firecode\calculators\_orca.py
12 2 -
A
firecode\numba_functions.py
25 2 -
A
firecode\embedder_options.py
33 5 -
A
firecode\calculators\dummy_ase_calc.py
1 1 -
A
docs\conf.py
 3 -
A
docs\requirements.txt
 1 -
A
firecode\pka.py
15 2 -
A
firecode\explode_search.py
16 1 -
A
firecode\concurrent_test.py
10 2 -
A
firecode\profiler.py
3 1 -
A
firecode\calculators\_ase_uma.py
20 1 1
A
firecode\algebra.py
11 4 1
A
firecode\operators.py
65 6 1
A
firecode\optimization_methods.py
55 5 1
A
firecode\reactive_atoms_classes.py
74 3 2
A
firecode\embeds.py
96 2 2
A
firecode\utils.py
82 5 2
A
firecode\torsion_module.py
109 4 2
A
firecode\atropisomer_module.py
58 3 3
A
firecode\calculators\_xtb.py
103 4 3