RandomConformerMover.hh

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// vi: set ts=2 noet:
//
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/// @file   protocols/ligand_docking/RandomConformerMover.hh
///
/// @brief
/// @author Ian W. Davis


#ifndef INCLUDED_protocols_ligand_docking_RandomConformerMover_hh
#define INCLUDED_protocols_ligand_docking_RandomConformerMover_hh

#include <protocols/ligand_docking/RandomConformerMover.fwd.hh>
#include <protocols/moves/Mover.hh>

#include <utility/vector1.hh>


namespace protocols {
namespace ligand_docking {


///@brief Replace the residue at the given position with a randomly selected
/// conformer from its rotamer library.
///@details Only tested on ligand residues.
/// If using torsion restraints, should be wrapped in an UnconstrainedTorsionsMover.
class RandomConformerMover : public protocols::moves::Mover
{
public:

  RandomConformerMover(core::Size resid);
  virtual ~RandomConformerMover();

  virtual void apply( core::pose::Pose & pose );
  virtual std::string get_name() const;

private:
  core::Size resid_;

}; // RandomConformerMover


} // namespace ligand_docking
} // namespace protocols

#endif // INCLUDED_protocols_ligand_docking_RandomConformerMover_HH