Rosetta  2020.46
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Classes | Namespaces | Functions
Rotate.hh File Reference
#include <protocols/ligand_docking/Rotate.fwd.hh>
#include <protocols/rigid/RigidBodyMover.fwd.hh>
#include <protocols/ligand_docking/DistributionMap.hh>
#include <protocols/moves/Mover.hh>
#include <protocols/qsar/scoring_grid/GridSet.fwd.hh>
#include <utility/tag/Tag.fwd.hh>
#include <basic/datacache/DataMap.fwd.hh>
#include <protocols/filters/Filter.fwd.hh>
#include <core/kinematics/Jump.hh>
#include <core/grid/CartGrid.fwd.hh>
#include <core/conformation/Residue.fwd.hh>
#include <utility/vector1.hh>

Classes

struct  protocols::ligand_docking::Rotate_info
 
struct  protocols::ligand_docking::Ligand_info
 
class  protocols::ligand_docking::Rotate
 

Namespaces

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

Functions

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)
 
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)
 
void protocols::ligand_docking::add_ligand_conditionally (Ligand_info const &ligand_info, utility::vector1< Ligand_info > &ligands, core::Size const heavy_atom_number)
 

Detailed Description

Author
Ian W. Davis