OBFloatGrid Member List

This is the complete list of members for OBFloatGrid, including all inherited members.

_halfSpace	OBFloatGrid	[protected]
_inv_spa	OBFloatGrid	[protected]
_ival	OBFloatGrid	[protected]
_midx	OBFloatGrid	[protected]
_midy	OBFloatGrid	[protected]
_midz	OBFloatGrid	[protected]
_spacing	OBFloatGrid	[protected]
_values	OBFloatGrid	[protected]
_vdata	OBBase	[protected]
_xAxis	OBFloatGrid	[protected]
_xdim	OBFloatGrid	[protected]
_xmax	OBGrid	[protected]
_xmin	OBGrid	[protected]
_yAxis	OBFloatGrid	[protected]
_ydim	OBFloatGrid	[protected]
_ymax	OBGrid	[protected]
_ymin	OBGrid	[protected]
_zAxis	OBFloatGrid	[protected]
_zdim	OBFloatGrid	[protected]
_zmax	OBGrid	[protected]
_zmin	OBGrid	[protected]
BeginData()	OBBase	[inline]
CastAndClear(bool clear=true)	OBBase	[inline]
Center()	OBFloatGrid	[inline]
ClassDescription()	OBBase	[inline, static]
Clear()	OBBase	[virtual]
CloneData(OBGenericData *d)	OBBase
CoordsToIndex(int *, double *)	OBFloatGrid
CoordsToIndex(double x, double y, double z)	OBFloatGrid
DataSize() const	OBBase	[inline]
DeleteData(unsigned int type)	OBBase
DeleteData(OBGenericData *)	OBBase
DeleteData(std::vector< OBGenericData * > &)	OBBase
DeleteData(const std::string &s)	OBBase
DoTransformations(const std::map< std::string, std::string > *, OBConversion *)	OBBase	[inline, virtual]
EndData()	OBBase	[inline]
GetAllData(const unsigned int type)	OBBase
GetData(const unsigned int type)	OBBase
GetData(const std::string &)	OBBase
GetData(const char *)	OBBase
GetData()	OBBase	[inline]
GetData(DataOrigin source)	OBBase
GetDataVector()	OBFloatGrid
GetDim(int *a)	OBFloatGrid	[inline]
GetHalfSpace() const	OBFloatGrid	[inline]
GetMax()	OBFloatGrid	[inline]
GetMax(double *a)	OBFloatGrid	[inline]
GetMidpointVector()	OBFloatGrid	[inline]
GetMin()	OBFloatGrid	[inline]
GetMin(double *a)	OBFloatGrid	[inline]
GetScale() const	OBFloatGrid	[inline]
GetSpacing() const	OBFloatGrid	[inline]
GetSpacing(double &s)	OBFloatGrid	[inline]
GetTitle(bool replaceNewlines=true) const	OBBase	[inline, virtual]
GetVals()	OBFloatGrid	[inline]
GetValue(int i, int j, int k)	OBFloatGrid	[inline]
GetXAxis() const	OBFloatGrid	[inline]
GetXdim() const	OBFloatGrid	[inline]
GetXmax() const	OBGrid	[inline]
GetXmin() const	OBGrid	[inline]
GetYAxis() const	OBFloatGrid	[inline]
GetYdim() const	OBFloatGrid	[inline]
GetYmax() const	OBGrid	[inline]
GetYmin() const	OBGrid	[inline]
GetZAxis() const	OBFloatGrid	[inline]
GetZdim() const	OBFloatGrid	[inline]
GetZmax() const	OBGrid	[inline]
GetZmin() const	OBGrid	[inline]
HasData(const std::string &)	OBBase
HasData(const char *)	OBBase
HasData(const unsigned int type)	OBBase
IndexToCoords(int idx, double &x, double &y, double &z)	OBFloatGrid
Init(OBMol &box, double spacing, double pad=0.0)	OBFloatGrid
OpenBabel::OBGrid::Init(OBMol &box)	OBGrid	[virtual]
Inject(double x, double y, double z)	OBFloatGrid
Interpolate(double, double, double)	OBFloatGrid
InterpolateDerivatives(double, double, double, double *derivatives)	OBFloatGrid
OBFloatGrid()	OBFloatGrid	[inline]
OBGrid()	OBGrid	[inline]
operator<<(std::ostream &, const OBFloatGrid &)	OBFloatGrid	[friend]
operator>>(std::istream &, OBFloatGrid &)	OBFloatGrid	[friend]
PointIsInBox(double x, double y, double z)	OBGrid	[inline]
PointIsInBox(double *c)	OBGrid	[inline]
PointIsInBox(vector3 v)	OBGrid	[inline]
SetData(OBGenericData *d)	OBBase	[inline]
SetLimits(const vector3 &origin, const vector3 &x, const vector3 &y, const vector3 &z)	OBFloatGrid
SetLimits(const double origin[3], const double x[3], const double y[3], const double z[3])	OBFloatGrid
SetNumberOfPoints(int nx, int ny, int nz)	OBFloatGrid
SetTitle(const char *)	OBBase	[inline, virtual]
SetVals(const std::vector< double > &vals)	OBFloatGrid
SetVals(double *ptr)	OBFloatGrid	[inline]
SetValue(int i, int j, int k, double val)	OBFloatGrid	[inline]
SetXAxis(vector3)	OBFloatGrid
SetYAxis(vector3)	OBFloatGrid
SetZAxis(vector3)	OBFloatGrid
~OBBase()	OBBase	[inline, virtual]
~OBFloatGrid()	OBFloatGrid	[inline]