OEIsClashingHBondInteractionHint

class OEIsClashingHBondInteractionHint : public OESystem::OEUnaryPredicate<OEInteractionHint>

This class represents OEIsClashingHBondInteractionHint functor that identifies clashing hydrogen bond interactions, i.e. geometrically unfavorable interactions between two acceptors or two donors that cannot form a proper hydrogen bond.

See also

• OEHBondInteractionHint class

• OEHBondInteractionHintType namespace

• OEInteractionHint class

• OEIsHBondInteractionHint predicate

• OEIsNonIdealHBondInteractionHint predicate

• OEIsUnpairedInteractionHint predicate

Constructors

OEIsClashingHBondInteractionHint() -> OEIsClashingHBondInteractionHint
OEIsClashingHBondInteractionHint(arg2: OEIsClashingHBondInteractionHint) -> OEIsClashingHBondInteractionHint

Default constructor.

operator()

__call__(c: OEInteractionHint) -> bool

Returns true, if the given interaction has a clashing hydrogen bond type i.e. the OEInteractionHint.GetInteractionType method returns an OEHBondInteractionHint with one of the following types:

• OEHBondInteractionHintType_ClashAcceptorAcceptor

• OEHBondInteractionHintType_ClashDonorDonor

CreateCopy

CreateCopy() -> OEUnaryInteractionHintBoolFunc

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