NoahHenrikKleinschmidt/buildamol

main

buildamol

Grade	Name	Complexity	Churn	Issues
A	support\pdbe_compounds\pubchem_to_cif.py	2	2	-
A	support\pdbe_compounds\size_filter.py	6	4	-
A	support\tools\add_example_gallery.py	6	1	-
A	tests\__init__.py		1	-
A	tests\base.py		6	-
A	tests\test_charmm.py	2	4	-
A	tests\test_optimizers.py	55	5	-
A	tests\test_pdbe_compounds.py	27	6	-
A	tests\test_toplevel.py	3	5	-