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Commit 1f4b9ed7 by Kyle Beauchamp
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Test atoms in LEU mutation

parent 63c86249
Showing with 4 additions and 0 deletions
tests/test_mutate.py
...@@ -43,6 +43,10 @@ def test_mutate_2(): ...@@ -43,6 +43,10 @@ def test_mutate_2():
desired_atom_names = set(["N", "CA", "CB", "C", "O", "H", "HA", "HB1", "HB2", "HB3"]) desired_atom_names = set(["N", "CA", "CB", "C", "O", "H", "HA", "HB1", "HB2", "HB3"])
assert atom_names == desired_atom_names, "Atom Names did not match for ALA 56" assert atom_names == desired_atom_names, "Atom Names did not match for ALA 56"
atom_names = set([atom.name for atom in new_residue57.atoms()])
desired_atom_names = set(["C", "N", "CA", "CB", "CG", "CD1", "CD2", "O", "H", "HA", "HB2", "HB3", "HD11", "HD12", "HD13", "HD21", "HD22", "HD23", "HG"])
assert atom_names == desired_atom_names, "Atom Names did not match for LEU 57"
@raises(ValueError) @raises(ValueError)
......
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