OEIsNonRingAtomDoubleBondedToRing¶
struct OEIsNonRingAtomDoubleBondedToRing : public OESystem::OEUnaryPredicate<OEChem::OEAtomBase>
This class represents the OEIsNonRingAtomDoubleBondedToRing functor that identifies non-ring atoms double bonded to a ring.
The following methods are publicly inherited from OEUnaryPredicate:
The following methods are publicly inherited from OEUnaryFunction:
operator()¶
bool operator()(const OEAtomBase &atom) const
Returns true
, if the OEAtomBase::IsInRing
method returns false
for the given
OEAtomBase object, and the atom is bonded to an atom
where the OEAtomBase::IsInRing
method returns true
and the order of the bond as determined by the
OEBondBase::GetOrder
method is 2.
CreateCopy¶
OESystem::OEUnaryFunction<OEChem::OEAtomBase , bool> *CreateCopy() const
Deep copy constructor that returns a copy of the object. The memory for the returned OEIsNonRingAtomDoubleBondedToRing 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.
See also
Example program ringsubset.cpp
Example program extractscaffold.cpp