rxn.chemutils.extended_reaction_smiles.to_extended_reaction_smiles

rxn.chemutils.extended_reaction_smiles.to_extended_reaction_smiles(reaction)[source]

Convert a ReactionEquation instance to an extended reaction SMILES (with potential fragment information).

Parameters

reaction (ReactionEquation) – reaction equation to convert

Return type

str

Returns

The extended reaction SMILES string.