residue.cpp File Reference

Handle macromolecule residues. More...

#include <openbabel/babelconfig.h>
#include <openbabel/residue.h>
#include <openbabel/atom.h>
#include <openbabel/oberror.h>
#include <openbabel/bitvec.h>
#include <openbabel/bond.h>
#include <cstring>
#include <cstdlib>

Namespaces

namespace  OpenBabel

Functions

static unsigned int GetAtomIDNumber (const char *atomid)
static unsigned int GetResidueNumber (const char *res)
static void SetResidueKeys (const char *residue, unsigned int &reskey, unsigned int &aakey)

Detailed Description

Handle macromolecule residues.