예제 #1
0
 def test_include_and_exclude(self):
     atom = Atom(mass=2.0 * u.g / u.mol, charge=30.0 * u.C, name="TestAtom")
     atom_json = atom.json(exclude={"mass"})
     assert "mass" not in atom_json
     atom_json = atom.json(exclude={"mass_"})
     assert "mass" not in atom_json
     atom_json = atom.json(include={"mass"})
     assert "name" not in atom_json
     atom_json = atom.json(include={"mass_"})
     assert "name" not in atom_json
예제 #2
0
    def test_atom_every_field_set(self, full_atom_type, are_equivalent_atoms):
        atom = Atom(
            name="test_atom",
            label="test_label",
            position=[0.0, 0.0, 0.0],
            charge=1.5,
            mass=2.0,
            element=element_by_symbol("C"),
            atom_type=full_atom_type,
        )

        atom_copy = Atom.parse_raw(atom.json())
        assert are_equivalent_atoms(atom, atom_copy)