/** * \file AngleRestraint.h \brief Angle restraint between three particles. * * Copyright 2007-2010 IMP Inventors. All rights reserved. * */ #ifndef IMPCORE_ANGLE_RESTRAINT_H #define IMPCORE_ANGLE_RESTRAINT_H #include "core_config.h" #include "AngleTripletScore.h" #include "XYZ.h" #include "TripletRestraint.h" #include #include IMPCORE_BEGIN_NAMESPACE //! Angle restraint between three particles /** \see AngleTripletScore */ class IMPCOREEXPORT AngleRestraint : public TripletRestraint { public: //! Create the angle restraint. /** \param[in] score_func Scoring function for the restraint. \param[in] p1 Pointer to first particle in angle restraint. \param[in] p2 Pointer to second particle in angle restraint. \param[in] p3 Pointer to third particle in angle restraint. */ AngleRestraint(UnaryFunction* score_func, Particle* p1, Particle* p2, Particle* p3); AngleRestraint(UnaryFunction* score_func, XYZ p0, XYZ p1, XYZ p2); }; IMPCORE_END_NAMESPACE #endif /* IMPCORE_ANGLE_RESTRAINT_H */