def test_write_gulp_format_with_filter(data_regression, file_regression):
data = read_lammps_format(lammps_file.splitlines())
data = filter_by_species(data, ["Fe core", "S core"])
data_regression.check(data)
output, nflags, nfit = write_gulp_format(data)
file_regression.check(six.ensure_text(output))
def test_round_trip_lammps_format(file_regression):
data = read_lammps_format(lammps_file.splitlines())
output = write_lammps_format(data)
file_regression.check(six.ensure_text(output))
def test_write_gulp_format(file_regression):
data = read_lammps_format(lammps_file.splitlines())
output, nflags, nfit = write_gulp_format(data)
file_regression.check(six.ensure_text(output))
def test_read_lammps_format(data_regression):
output = read_lammps_format(lammps_file.splitlines())
data_regression.check(output)