ChemicalReaction.hh File Reference

A reaction object that keeps track of its fragment sets. More...

#include <protocols/drug_design/ChemicalReaction.fwd.hh>
#include <core/chemical/rdkit/RDKit.fwd.hh>
#include <core/types.hh>
#include <utility/VirtualBase.hh>
#include <utility/vector1.hh>
#include <utility/vector0.hh>
#include <rdkit/GraphMol/ROMol.h>
#include <rdkit/GraphMol/ChemReactions/Reaction.h>
#include <rdkit/GraphMol/ChemReactions/ReactionParser.h>

Classes
class	protocols::drug_design::ChemicalReaction

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

Detailed Description

A reaction object that keeps track of its fragment sets.

Author

Yidan Tang (yidan.nosp@m..tan.nosp@m.g@van.nosp@m.derb.nosp@m.ilt.e.nosp@m.du)