OEAtomIsInAgent

class OEAtomIsInAgent : public OESystem::OEUnaryPredicate<OEChem::OEAtomBase>

This class represents OEAtomIsInAgent functor that identifies atoms of the catalysts or solvents of a reaction.

The following methods are publicly inherited from OEUnaryPredicate:

operator()

CreateCopy

CreatePredicateCopy

The following methods are publicly inherited from OEUnaryFunction:

operator()

CreateCopy

operator()

bool operator()(const OEAtomBase &atom) const

Returns true, if the OEAtomBase::GetRxnRole method returns OERxnRole::Agent for the given OEAtomBase object.

CreateCopy

OESystem::OEUnaryFunction<OEChem::OEAtomBase , bool> *CreateCopy() const

Deep copy constructor that returns a copy of the object. The memory for the returned OEAtomIsInAgent object is dynamically allocated and owned by the caller.

The returned copy should be deallocated using C++ delete operator in order to prevent a memory leak.