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ChemicalManager.hh File Reference

Chemical manager class header. More...

#include <core/chemical/ChemicalManager.fwd.hh>
#include <core/chemical/AtomTypeSet.fwd.hh>
#include <core/chemical/ElementSet.fwd.hh>
#include <core/chemical/IdealBondLengthSet.fwd.hh>
#include <core/chemical/MMAtomTypeSet.fwd.hh>
#include <core/chemical/gasteiger/GasteigerAtomTypeSet.fwd.hh>
#include <core/chemical/orbitals/OrbitalTypeSet.fwd.hh>
#include <core/chemical/ResidueTypeSet.fwd.hh>
#include <core/chemical/GlobalResidueTypeSet.fwd.hh>
#include <utility/SingletonBase.hh>
#include <map>

Classes

class  core::chemical::ChemicalManager
 a class managing different sets of atom_type_set and residue_type_set More...
 

Namespaces

 core
 A class for reading in the atom type properties.
 
 core::chemical
 

Functions

TypeSetMode core::chemical::type_set_mode_from_string (std::string const &mode, bool fail)
 
std::string core::chemical::string_from_type_set_mode (TypeSetMode mode)
 
std::ostream & core::chemical::operator<< (std::ostream &out, TypeSetMode mode)
 

Detailed Description

Chemical manager class header.

Author
Andrew Leaver-Fay (leave.nosp@m.rfa@.nosp@m.email.nosp@m..unc.nosp@m..edu)