phmodel.h File Reference

Read pH rules and assign charges. More...

#include "parsmart.h"
#include "data.h"

Go to the source code of this file.

Namespaces

namespace OpenBabel

Classes

class OBChemTsfm

SMARTS based structural modification (chemical transformation). More...

class OBPhModel

Corrections for pH used by OBMol::CorrectForPH(). More...

Detailed Description

Read pH rules and assign charges.