BurialEnergy.hh

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// vi: set ts=2 noet:
//
// (c) Copyright Rosetta Commons Member Institutions.
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/// @file   core/scoring/methods/BurialEnergy.hh
/// @brief  energy term use for scoring predicted burial
/// @author James Thompson

#ifndef INCLUDED_core_scoring_methods_BurialEnergy_hh
#define INCLUDED_core_scoring_methods_BurialEnergy_hh

#include <core/scoring/methods/BurialEnergyCreator.hh>
#include <core/scoring/methods/ContextDependentOneBodyEnergy.hh>
#include <core/scoring/ScoreType.hh>
#include <core/scoring/ScoreFunction.fwd.hh>

#include <core/pose/Pose.fwd.hh>
#include <utility/vector1.fwd.hh>

#include <utility/vector1.hh>


namespace core {
namespace scoring {
namespace methods {


class BurialEnergy : public ContextDependentOneBodyEnergy {
public:

  BurialEnergy() : ContextDependentOneBodyEnergy( new BurialEnergyCreator ) {
    init_from_file();
  }

  /// clone
  virtual
  EnergyMethodOP
  clone() const;

  /////////////////////////////////////////////////////////////////////////////
  // scoring
  /////////////////////////////////////////////////////////////////////////////

  virtual void
  residue_energy(
    conformation::Residue const & rsd,
    pose::Pose const & pose,
    EnergyMap & emap
  ) const;

  void
  setup_for_scoring(
     pose::Pose & pose, ScoreFunction const &
  ) const;

  void
  finalize_total_energy(
    pose::Pose &,
    ScoreFunction const &,
    EnergyMap &
  ) const {}

  virtual
  core::Size version() const;

  void
  indicate_required_context_graphs(
    utility::vector1< bool > & /*context_graphs_required*/
  ) const;

private:
  void init_from_file();
  utility::vector1< core::Real > pred_burial_;
};

}
}
}

#endif // INCLUDED_core_scoring_methods_BurialEnergy_HH