ConstraintFragmentMover.hh

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/// @brief  set of fragments for a certain alignment frame
/// @author Oliver Lange (olange@u.washington.edu)
/// @date   Wed Oct 20 12:08:31 2007
///


#ifndef INCLUDED_protocols_simple_moves_ConstraintFragmentMover_HH
#define INCLUDED_protocols_simple_moves_ConstraintFragmentMover_HH

// Unit Headers
//#include <protocols/simple_moves/ConstraintFragmentMover.fwd.hh>
#include <protocols/simple_moves/SmoothFragmentMover.hh>

// Package Headers
#include <protocols/simple_moves/FragmentMover.fwd.hh>

// Project Headers
#include <core/types.hh>
#include <core/fragment/FragSet.hh>
#include <core/pose/Pose.fwd.hh>

#include <core/kinematics/MoveMap.hh>

// Utility headers
#include <utility/vector1.fwd.hh>

namespace protocols {
namespace simple_moves {

typedef utility::vector1< core::Real > ScoreList;


class ConstraintFragmentMover : public ClassicFragmentMover {
public:
  ConstraintFragmentMover(
    core::fragment::FragSetCOP fragset,
    core::kinematics::MoveMapCOP movemap,
    FragmentCostOP cost )
  :
    ClassicFragmentMover( fragset, movemap, "SmoothFragmentMover_"+cost->type() ),
    cost_( cost )
  {}

  //   void apply( core::pose::Pose & );
protected:
  ConstraintFragmentMover(
          core::fragment::FragSetCOP fragset,
          core::kinematics::MoveMapCOP movemap,
          FragmentCostOP cost,
          std::string move_type ) :
    ClassicFragmentMover( fragset, movemap, move_type+"_"+cost->type() ),
    cost_( cost ) {}

  // frame and fragment of choice, returns false if no good fragment is found
  bool choose_fragment( core::fragment::FrameList const&, core::pose::Pose const&, Size &frame_num, Size &frag_num );

private:
  FragmentCostOP cost_;

  // choose randomly fragments that are below cutoff_
  core::Real cutoff_;

};

} //simple_moves
} //protocols

#endif