iodata.test.test_pdb module¶

Test iodata.formats.pdb module.

check_water(mol)[source]¶: Test some things on a water file.

test_indomethacin_dimer()[source]¶

test_load_2bcw()[source]¶

test_load_ch5plus_bonds()[source]¶

test_load_dump_consistency(fn_base, should_warn, tmpdir)[source]¶

test_load_dump_many_consistency(case, tmpdir)[source]¶

test_load_dump_xyz_consistency(tmpdir)[source]¶

test_load_many(case)[source]¶

test_load_peptide_2luv()[source]¶

test_load_water(case)[source]¶

test_load_water_no_end()[source]¶