Rotate.cc File Reference

#include <protocols/ligand_docking/Rotate.hh>
#include <protocols/ligand_docking/RotateCreator.hh>
#include <protocols/ligand_docking/grid_functions.hh>
#include <protocols/rigid/RB_geometry.hh>
#include <protocols/rigid/RigidBodyMover.hh>
#include <core/pose/util.hh>
#include <core/pose/chains_util.hh>
#include <core/pose/Pose.hh>
#include <core/conformation/Conformation.hh>
#include <core/conformation/Residue.hh>
#include <core/pack/task/PackerTask.fwd.hh>
#include <core/pack/task/TaskFactory.hh>
#include <core/pack/palette/NoDesignPackerPalette.hh>
#include <core/scoring/rms_util.tmpl.hh>
#include <protocols/qsar/scoring_grid/GridSet.fwd.hh>
#include <protocols/qsar/scoring_grid/schema_util.hh>
#include <numeric/random/random.hh>
#include <utility>
#include <utility/exit.hh>
#include <basic/Tracer.hh>
#include <core/types.hh>
#include <algorithm>
#include <utility/tag/Tag.hh>
#include <utility/excn/Exceptions.hh>
#include <utility/vector1.hh>
#include <utility/tag/XMLSchemaGeneration.hh>
#include <protocols/moves/mover_schemas.hh>

Namespaces
	protocols
	The instance of Loops contained by AbrelaxApplication should be replaced by a LoopsOP.
	protocols::ligand_docking

Functions
static basic::Tracer	protocols::ligand_docking::TR ("protocols.ligand_docking.ligand_options.rotate")
void	protocols::ligand_docking::add_ligand_conditionally (Ligand_info const &ligand_info, utility::vector1< Ligand_info > &ligands, core::Size const heavy_atom_number)
void	protocols::ligand_docking::apply_rotate (protocols::rigid::RigidBodyMoverOP mover, core::pose::Pose &pose, core::Vector const &center, core::Size jump_id, utility::vector1< core::Size > const tag_along_jumps)
bool	protocols::ligand_docking::check_score (Ligand_info const &ligand, core::Size const heavy_atom_number)
	Convenience Functions for use with Rotate. More...
bool	protocols::ligand_docking::check_RMSD (Ligand_info const &ligand, core::Size const heavy_atom_number, utility::vector1< Ligand_info > const &ligands)

Detailed Description

Author

Gordon Lemmon (glemm.nosp@m.on@g.nosp@m.mail..nosp@m.com)