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Searched refs:molecule_column (Results 1 – 2 of 2) sorted by relevance

/dports/science/py-oddt/oddt-0.7/oddt/
H A Dpandas.py15 molecule_column='mol', argument
69 if molecule_column is None:
88 if molecule_column:
143 molecule_column = molecule_column or data._molecule_column
183 molecule_column='mol', argument
230 molecule_column=molecule_column,
292 molecule_column=molecule_column,
404 molecule_column = molecule_column or self._molecule_column
409 molecule_column=molecule_column,
437 molecule_column = molecule_column or self._molecule_column
[all …]
/dports/science/py-oddt/oddt-0.7/tests/
H A Dtest_pandas.py47 molecule_column=None,
131 molecule_column='mol')