IMP  2.1.0
The Integrative Modeling Platform
protein_ligand_score.h File Reference

Functions to read mol2s. More...

#include <IMP/atom/atom_config.h>
#include "Hierarchy.h"
#include <IMP/core/StatisticalPairScore.h>
#include <IMP/kernel/Model.h>
#include <IMP/kernel/Particle.h>
#include <IMP/kernel/Restraint.h>
#include <IMP/PairScore.h>
#include <IMP/container/PairsRestraint.h>
#include <IMP/algebra/Vector3D.h>
#include <IMP/base/file.h>
#include <limits>
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Classes

class  IMP::atom::ProteinLigandAtomPairScore
 
class  IMP::atom::ProteinLigandRestraint
 

Namespaces

 IMP
 All IMP::kernel code is brought into the IMP namespace.
 
 IMP::atom
 See IMP.atom for more information.
 

Protein-ligand scoring

IMP provides a statistical scoring function for scoring protein-ligand complexes. See the Ligand Score application for more information.

typedef Key< 783462, false > IMP::atom::ProteinLigandType
 
typedef IMP::base::Vector
< ProteinLigandType > 
IMP::atom::ProteinLigandTypes
 
typedef IMP::base::Vector
< IMP::base::Pointer
< ProteinLigandAtomPairScore > > 
IMP::atom::ProteinLigandAtomPairScores
 
typedef IMP::base::Vector
< IMP::base::WeakPointer
< ProteinLigandAtomPairScore > > 
IMP::atom::ProteinLigandAtomPairScoresTemp
 
typedef IMP::base::Vector
< IMP::base::Pointer
< ProteinLigandRestraint > > 
IMP::atom::ProteinLigandRestraints
 
typedef IMP::base::Vector
< IMP::base::WeakPointer
< ProteinLigandRestraint > > 
IMP::atom::ProteinLigandRestraintsTemp
 
void IMP::atom::add_protein_ligand_score_data (Hierarchy h)
 

Detailed Description

Copyright 2007-2013 IMP Inventors. All rights reserved.

Definition in file protein_ligand_score.h.