iodata.test.test_mol2 module¶

Test iodata.formats.mol2 module.

check_example(mol)[source]¶: Test some things on example file.

check_load_dump_consistency(tmpdir, fn)[source]¶: Check if dumping and loading an MOL2 file results in the same data.

test_bondtypes_benzene()[source]¶

test_load_dump_consistency(tmpdir)[source]¶

test_load_dump_many_consistency(tmpdir)[source]¶

test_load_dump_wrong_bond_num(tmpdir)[source]¶

test_load_many()[source]¶

test_load_water_bonds_warning()[source]¶

test_mol2_formaterror(tmpdir)[source]¶

test_mol2_load_one()[source]¶

test_mol2_symbol()[source]¶