Currently, reactions with resonance would return None, None in the function generate_reaction_complex if the input reactants or products are not the exact resonance structure in the reaction, even if the resonance option is set to True. This is caused by find_reaction_family, where no resonance is considered when generating family_label.
This PR passes the resonance option from generate_reaction_complex to find_reaction_family to enable the generation of family_label with resonance.
Currently, reactions with resonance would return
None, Nonein the functiongenerate_reaction_complexif the input reactants or products are not the exact resonance structure in the reaction, even if theresonanceoption is set toTrue. This is caused byfind_reaction_family, where no resonance is considered when generatingfamily_label.This PR passes the
resonanceoption fromgenerate_reaction_complextofind_reaction_familyto enable the generation offamily_labelwith resonance.