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FIRECODE
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Grade
Name
Complexity
Churn
Issues
F
firecode\embedder.py
445 22 11
C
firecode\ase_manipulations.py
95 16 5
B
firecode\thermochemistry.py
48 5 5
A
firecode\embeds.py
79 7 3
A
firecode\torsion_module.py
135 10 3
A
firecode\interfaces\crest.py
69 2 3
A
firecode\utils.py
69 17 2
A
firecode\interfaces\goat.py
44 2 2
A
firecode\atropisomer_module.py
53 9 2
A
firecode\standalone_optimizer.py
72 12 1
A
firecode\ensemble.py
35 2 1
A
firecode\rdkit_tools.py
45 4 1
A
firecode\reactive_atoms_classes.py
72 6 1
A
firecode\operators.py
62 19 1
A
firecode\calculators\solvation_delta_calc.py
10 1 1
A
firecode\calculators\xtb.py
43 2 1
A
firecode\md\packmol.py
5 1 1
A
firecode\dispatcher.py
32 2 1
A
.readthedocs.yaml
 1 -
A
firecode\algebra.py
4 6 -