poseClustering.h File Reference

#include <BALL/DATATYPE/options.h>
#include <BALL/DOCKING/COMMON/conformationSet.h>
#include <BALL/MOLMEC/COMMON/snapShot.h>
#include <BALL/STRUCTURE/atomBijection.h>
#include <BALL/KERNEL/system.h>
#include <BALL/DATATYPE/string.h>
#include <BALL/MATHS/vector3.h>
#include <BALL/MATHS/matrix44.h>
#include <Eigen/Core>
#include <boost/shared_ptr.hpp>
#include <boost/variant.hpp>
#include <boost/graph/adjacency_list.hpp>
#include <set>
#include <iostream>

Go to the source code of this file.

Classes
class	BALL::PoseClustering
	Computation of clusters of docking poses. More...
struct	BALL::PoseClustering::Option
	Option names. More...
struct	BALL::PoseClustering::Default
	Default values for options. More...
class	BALL::PoseClustering::RigidTransformation
class	BALL::PoseClustering::PosePointer
class	BALL::PoseClustering::ClusterProperties
class	BALL::PoseClustering::ClusterTreeWriter_
class	BALL::PoseClustering::ClusterTreeNodeComparator

Namespaces
	BALL
	-*- Mode: C++; tab-width: 2; -*-

Variables
	SNAPSHOT_RMSD
	RIGID_RMSD
	C_ALPHA
	HEAVY_ATOMS
	BACKBONE
	ALL_ATOMS
	TRIVIAL_COMPLETE_LINKAGE
	SLINK_SIBSON
	CLINK_DEFAYS
	NEAREST_NEIGHBOR_CHAIN_WARD

Variable Documentation

ALL_ATOMS

Definition at line 167 of file poseClustering.h.

BACKBONE

Definition at line 167 of file poseClustering.h.

C_ALPHA

Definition at line 167 of file poseClustering.h.

CLINK_DEFAYS

Definition at line 176 of file poseClustering.h.

HEAVY_ATOMS

Definition at line 167 of file poseClustering.h.

NEAREST_NEIGHBOR_CHAIN_WARD

Definition at line 176 of file poseClustering.h.

RIGID_RMSD

Definition at line 160 of file poseClustering.h.

SLINK_SIBSON

Definition at line 176 of file poseClustering.h.

SNAPSHOT_RMSD

Definition at line 160 of file poseClustering.h.

TRIVIAL_COMPLETE_LINKAGE

Definition at line 176 of file poseClustering.h.