RDKit
Open-source cheminformatics and machine learning.
point.h File Reference
#include <iostream>
#include <cmath>
#include <vector>
#include <map>
#include <RDGeneral/Invariant.h>
#include <Numerics/Vector.h>
#include <boost/smart_ptr.hpp>

Go to the source code of this file.

Classes

class  RDGeom::Point
 
class  RDGeom::Point3D
 
class  RDGeom::Point2D
 
class  RDGeom::PointND
 

Namespaces

 RDGeom
 

Macros

#define M_PI   3.14159265358979323846
 

Typedefs

typedef std::vector< RDGeom::Point * > RDGeom::PointPtrVect
 
typedef PointPtrVect::iterator RDGeom::PointPtrVect_I
 
typedef PointPtrVect::const_iterator RDGeom::PointPtrVect_CI
 
typedef std::vector< RDGeom::Point3D * > RDGeom::Point3DPtrVect
 
typedef std::vector< RDGeom::Point2D * > RDGeom::Point2DPtrVect
 
typedef Point3DPtrVect::iterator RDGeom::Point3DPtrVect_I
 
typedef Point3DPtrVect::const_iterator RDGeom::Point3DPtrVect_CI
 
typedef Point2DPtrVect::iterator RDGeom::Point2DPtrVect_I
 
typedef Point2DPtrVect::const_iterator RDGeom::Point2DPtrVect_CI
 
typedef std::vector< const RDGeom::Point3D * > RDGeom::Point3DConstPtrVect
 
typedef Point3DConstPtrVect::iterator RDGeom::Point3DConstPtrVect_I
 
typedef Point3DConstPtrVect::const_iterator RDGeom::Point3DConstPtrVect_CI
 
typedef std::vector< Point3D > RDGeom::POINT3D_VECT
 
typedef std::vector< Point3D >::iterator RDGeom::POINT3D_VECT_I
 
typedef std::vector< Point3D >::const_iterator RDGeom::POINT3D_VECT_CI
 
typedef std::map< int, Point2D > RDGeom::INT_POINT2D_MAP
 
typedef INT_POINT2D_MAP::iterator RDGeom::INT_POINT2D_MAP_I
 
typedef INT_POINT2D_MAP::const_iterator RDGeom::INT_POINT2D_MAP_CI
 

Functions

double RDGeom::computeDihedralAngle (const Point3D &pt1, const Point3D &pt2, const Point3D &pt3, const Point3D &pt4)
 
double RDGeom::computeSignedDihedralAngle (const Point3D &pt1, const Point3D &pt2, const Point3D &pt3, const Point3D &pt4)
 
std::ostream & RDGeom::operator<< (std::ostream &target, const RDGeom::Point &pt)
 
RDGeom::Point3D RDGeom::operator+ (const RDGeom::Point3D &p1, const RDGeom::Point3D &p2)
 
RDGeom::Point3D RDGeom::operator- (const RDGeom::Point3D &p1, const RDGeom::Point3D &p2)
 
RDGeom::Point3D RDGeom::operator* (const RDGeom::Point3D &p1, double v)
 
RDGeom::Point3D RDGeom::operator/ (const RDGeom::Point3D &p1, double v)
 
RDGeom::Point2D RDGeom::operator+ (const RDGeom::Point2D &p1, const RDGeom::Point2D &p2)
 
RDGeom::Point2D RDGeom::operator- (const RDGeom::Point2D &p1, const RDGeom::Point2D &p2)
 
RDGeom::Point2D RDGeom::operator* (const RDGeom::Point2D &p1, double v)
 
RDGeom::Point2D RDGeom::operator/ (const RDGeom::Point2D &p1, double v)
 
RDGeom::PointND RDGeom::operator+ (const RDGeom::PointND &p1, const RDGeom::PointND &p2)
 
RDGeom::PointND RDGeom::operator- (const RDGeom::PointND &p1, const RDGeom::PointND &p2)
 
RDGeom::PointND RDGeom::operator* (const RDGeom::PointND &p1, double v)
 
RDGeom::PointND RDGeom::operator/ (const RDGeom::PointND &p1, double v)
 

Macro Definition Documentation

#define M_PI   3.14159265358979323846

Definition at line 19 of file point.h.

Referenced by RDGeom::Point3D::signedAngleTo(), and RDGeom::Point2D::signedAngleTo().