Reprotonate.hh File Reference

Heuristically reprotonate a molecule to be in neutral pH. More...

#include <core/chemical/modifications/Reprotonate.fwd.hh>
#include <core/chemical/modifications/ChemistryBase.hh>
#include <core/chemical/MutableResidueType.fwd.hh>
#include <core/types.hh>

Classes
class	core::chemical::modifications::Reprotonate

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

Detailed Description

Heuristically reprotonate a molecule to be in neutral pH.

Author

Rocco Moretti (rmore.nosp@m.ttia.nosp@m.se@gm.nosp@m.ail..nosp@m.com)