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iodata
29
issues
2
pull requests
110
files
1
active branch
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CodeFactor Rating A
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Grade
Name
Complexity
Churn
Issues
A
iodata\periodic.py
7
-
A
docs\requirements.txt
3
-
A
iodata\test\test_mol2.py
8
-
A
docs\_static\css\table.css
1
-
A
docs\example_scripts\write_gaussian_com_lot.py
1
-
A
docs\example_scripts\load_water_foo.py
2
-
A
.github\workflows\release.yaml
3
-
A
iodata\overlap_cartpure.py
3
-
A
.codecov.yml
2
-
A
iodata\test\test_gaussianinput.py
6
-
A
docs\example_scripts\write_gaussian_com.py
1
-
A
docs\example_scripts\convert_fchk_xyz_traj.py
1
-
A
docs\example_scripts\convert_fchk_molden.py
2
-
A
iodata\test\test_sdf.py
7
-
A
iodata\test\test_molden.py
30
-
A
iodata\test\test_inputs.py
10
-
A
iodata\test\data\__init__.py
1
-
A
docs\example_scripts\load_water.py
1
-
A
docs\example_scripts\test_scripts.py
1
1
-
A
iodata\formats\locpot.py
1
7
-
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