def test_build_pandas_dataframe():
tmpdir = tempfile.mkdtemp()
from thermopyl.utils import build_pandas_dataframe, pandas_dataframe
# Generate dataframe
filenames = [get_fn("je8006138.xml")]
[data, compounds] = build_pandas_dataframe(filenames)
# Write as HDF5
data.to_hdf(os.path.join(tmpdir, 'data.h5'), 'data')
compounds.to_hdf(os.path.join(tmpdir, 'compound_name_to_formula.h5'), 'data')
# Read dataframe
df = pandas_dataframe(thermoml_path=tmpdir)
# Clean up tmpdir
import shutil
shutil.rmtree(tmpdir)
def test_thermopyl():
filename = get_fn("je8006138.xml")
parser = thermoml_lib.Parser(filename)
current_data = parser.parse()
name_to_formula = parser.compound_name_to_formula
def test_thermopyl():
filename = get_fn("je8006138.xml")
parser = thermoml_lib.Parser(filename)
current_data = parser.parse()
name_to_formula = parser.compound_name_to_formula