class OEClashInteractionHint : public OEInteractionHintTypeBase
The OEClashInteractionHint class represents a built-in type that identifies interactions stored in an OEInteractionHintContainer object as intermolecular clash interactions.
See also
The following methods are publicly inherited from OEInteractionHintTypeBase:
| operator= | operator== | GetName |
| operator!= | CreateCopy | IsValid |
OEClashInteractionHint()
Default constructor.
OEClashInteractionHint(const OEClashInteractionHint &rhs)
Copy constructor.
OEClashInteractionHint &operator=(const OEClashInteractionHint &rhs)
Assignment operator.
OEInteractionHintTypeBase *CreateCopy() const
Deep copy constructor that returns a copy of the object. The memory for the returned OEClashInteractionHint object is dynamically allocated and owned by the caller.
bool IsValid(const OEInteractionHintFragment *,
const OEInteractionHintFragment *) const
Evaluates whether the two given fragments would form a valid clash interaction when added to an OEInteractionHintContainer object.
It checks that each fragment contains exactly one atom, and the fragments belong to different molecules i.e. it is an intermolecular interaction.