Rosetta  2021.16
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TorsionSampler.cc File Reference

Sample torsions based on experimental distributions. More...

#include <basic/basic.hh>
#include <basic/Tracer.hh>
#include <basic/options/option.hh>
#include <basic/database/open.hh>
#include <basic/options/keys/score.OptionKeys.gen.hh>
#include <basic/options/keys/corrections.OptionKeys.gen.hh>
#include <core/scoring/GenericBondedPotential.fwd.hh>
#include <core/scoring/GenericBondedPotential.hh>
#include <utility/io/izstream.hh>
#include <numeric/random/random.hh>
#include <protocols/ligand_docking/GALigandDock/TorsionSampler.hh>

Namespaces

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

Enumerations

enum  protocols::ligand_docking::ga_ligand_dock::ReadMode {
  protocols::ligand_docking::ga_ligand_dock::rmNONE, protocols::ligand_docking::ga_ligand_dock::rmATOM, protocols::ligand_docking::ga_ligand_dock::rmBOND, protocols::ligand_docking::ga_ligand_dock::rmANGLE,
  protocols::ligand_docking::ga_ligand_dock::rmTORSION, protocols::ligand_docking::ga_ligand_dock::rmIMPROPER
}
 

Functions

static basic::Tracer protocols::ligand_docking::ga_ligand_dock::TR ("protocols.ligand_docking.GALigandDock.TorsionSampler")
 

Detailed Description

Sample torsions based on experimental distributions.

Author
Guangfeng Zhou and Frank DiMaio