pack_missing_sidechains.hh

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// vi: set ts=2 noet:
//
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/// @file   core/pack/pack_missing_sidechains.hh
/// @brief  header for subroutine to run rotamer trials on residues missing sidechain density in a PDB
/// @author Steven Lewis smlewi@gmail.com

#ifndef INCLUDED_core_pack_pack_missing_sidechains_hh
#define INCLUDED_core_pack_pack_missing_sidechains_hh

// Project headers
#include <core/id/AtomID_Mask.fwd.hh>
#include <core/pose/Pose.fwd.hh>
#include <utility/vector1.fwd.hh>

#include <utility/vector1.hh>


namespace core {
namespace pack {

///@brief This function runs rotamer trials on residues missing sidechain density (as described by the AtomID_Mask)
void
pack_missing_sidechains(
  pose::Pose & pose,
  id::AtomID_Mask const& missing
);

///@brief return vector of bools with true for each residue that has >=1 atom in to_repack that is not VIRTUAL, ORBS or LPbb
bool figure_out_repackable_residues(
  core::pose::Pose & pose,
  core::id::AtomID_Mask const& to_repack,
  utility::vector1_bool& repackable
);


} //namespace pack
} //namespace core

#endif //INCLUDED_core_pack_pack_missing_sidechains_HH