DockingEnsemble.hh File Reference

container class for ensemble docking information to be used with ConformerSwitchMover More...

#include <protocols/docking/DockingEnsemble.fwd.hh>
#include <protocols/moves/Mover.hh>
#include <protocols/moves/MoverContainer.hh>
#include <core/types.hh>
#include <core/pose/Pose.hh>
#include <core/scoring/ScoreFunction.hh>
#include <map>
#include <string>
#include <utility/pointer/ReferenceCount.hh>
#include <utility/vector0.hh>
#include <utility/vector1.hh>

Classes
class	protocols::docking::DockingEnsemble
	this mover does the conformer swap in RosettaDock's ensemble docking. It takes in a multi-model PDB file as an ensemble, and does swaps conformers by superpositioning over interface residues, and selects a conformer based on a partition function using a ScoreFunction. More...

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

Detailed Description

container class for ensemble docking information to be used with ConformerSwitchMover

Author

Monica Berrondo