rxn.metrics.true_reactant_accuracy.get_standardized_true_reactants

rxn.metrics.true_reactant_accuracy.get_standardized_true_reactants(mapped_rxn_smiles)[source]

Get the reactants that contribute atoms to the product, and standardize them.

Return type

Optional[List[str]]

Returns

The sorted list of “true reactants”, None if something is not right.

Parameters

mapped_rxn_smiles (str) –