atom.cpp File Reference

Handle OBAtom class. More...

#include <openbabel/babelconfig.h>
#include <openbabel/atom.h>
#include <openbabel/stereo/stereo.h>
#include <openbabel/mol.h>
#include <openbabel/molchrg.h>
#include <openbabel/phmodel.h>
#include <openbabel/builder.h>
#include <openbabel/math/matrix3x3.h>

Namespaces

namespace  OpenBabel

Defines

#define ONE_OVER_SQRT3   0.57735026918962576451
#define SQRT_TWO_THIRDS   0.81649658092772603272

Functions

int strncasecmp (const char *s1, const char *s2, size_t n)
static void ApplyRotMatToBond (OBMol &mol, matrix3x3 &m, OBAtom *a1, OBAtom *a2)

Variables

OBPhModel phmodel

Detailed Description

Handle OBAtom class.


Define Documentation

#define ONE_OVER_SQRT3   0.57735026918962576451

Referenced by OBAtom::SetHybAndGeom().

#define SQRT_TWO_THIRDS   0.81649658092772603272

Referenced by OBAtom::SetHybAndGeom().


Function Documentation

int strncasecmp ( const char *  s1,
const char *  s2,
size_t  n 
)
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