OEIsIntermolecularStackingInteractionHint

class OEIsIntermolecularStackingInteractionHint : public OESystem::OEUnaryPredicate<OEInteractionHint>

This class represents OEIsIntermolecularStackingInteractionHint functor that identifies stacking interactions between aromatic rings in different molecules (i.e. between the ligand and the protein).

See also

• OEStackingInteractionHint class

• OEStackingInteractionHintType namespace

• OEInteractionHint class

• OEIsStackingInteractionHint predicate

• OEIsIntramolecularStackingInteractionHint predicate

Constructors

OEIsIntermolecularStackingInteractionHint()

Default constructor.

operator=

OEIsIntermolecularStackingInteractionHint & operator=(const OEIsIntermolecularStackingInteractionHint &)

Assignment operator.

operator()

bool operator()(const OEInteractionHint& i) const

Returns true, if the given interaction has an intermolecular stacking type i.e. the OEInteractionHint::GetInteractionType method returns an OEStackingInteractionHint with one of the following types:

• OEStackingInteractionHintType::Pi

• OEStackingInteractionHintType::T

CreateCopy

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

Deep copy constructor that returns a copy of the object. The memory for the returned OEIsIntermolecularStackingInteractionHint 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.