OBProxGrid Member List

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

_gridtype OBProxGrid [protected]

_inc OBProxGrid [protected]

_maxinc OBProxGrid [protected]

_nxinc OBProxGrid [protected]

_nyinc OBProxGrid [protected]

_nzinc OBProxGrid [protected]

_vdata OBBase [protected]

_xmax OBGrid [protected]

_xmin OBGrid [protected]

_ymax OBGrid [protected]

_ymin OBGrid [protected]

_zmax OBGrid [protected]

_zmin OBGrid [protected]

BeginData() OBBase [inline]

CastAndClear(bool clear=true) OBBase [inline]

cell OBProxGrid [protected]

ClassDescription() OBBase [inline, static]

Clear() OBBase [virtual]

DataSize() const OBBase [inline]

DeleteData(unsigned int type) OBBase

DeleteData(OBGenericData *) OBBase

DeleteData(std::vector< OBGenericData * > &) OBBase

DoTransformations(const std::map< std::string, std::string > *) OBBase [inline, virtual]

EndData() OBBase [inline]

GetData(const unsigned int type) OBBase

GetData(const std::string &) OBBase

GetData(const char *) OBBase

GetData() OBBase [inline]

GetData(DataOrigin source) OBBase

GetProxVector(double, double, double) OBProxGrid

GetProxVector(double *) OBProxGrid

GetXmax() const OBGrid [inline]

GetXmin() const OBGrid [inline]

GetYmax() const OBGrid [inline]

GetYmin() const OBGrid [inline]

GetZmax() const OBGrid [inline]

GetZmin() const OBGrid [inline]

HasData(const std::string &) OBBase

HasData(const char *) OBBase

HasData(const unsigned int type) OBBase

Init(OBMol &box) OBGrid [virtual]

LipoGrid() OBProxGrid [inline]

OBGrid() OBGrid [inline]

OBProxGrid(int gridtype=0) OBProxGrid [inline]

PointIsInBox(double x, double y, double z) OBGrid [inline]

PointIsInBox(double *c) OBGrid [inline]

PolarGrid() OBProxGrid [inline]

SetData(OBGenericData *d) OBBase [inline]

SetGridType(int gridtype) OBProxGrid [inline]

Setup(OBMol &mol, OBMol &box, double cutoff, double resolution=0.5) OBProxGrid

Setup(OBMol &mol, OBMol &box, double cutoff, std::vector< bool > &use, double resolution=0.5) OBProxGrid

~OBBase() OBBase [inline, virtual]

~OBProxGrid() OBProxGrid [inline]

_gridtype	OBProxGrid	`[protected]`
_inc	OBProxGrid	`[protected]`
_maxinc	OBProxGrid	`[protected]`
_nxinc	OBProxGrid	`[protected]`
_nyinc	OBProxGrid	`[protected]`
_nzinc	OBProxGrid	`[protected]`
_vdata	OBBase	`[protected]`
_xmax	OBGrid	`[protected]`
_xmin	OBGrid	`[protected]`
_ymax	OBGrid	`[protected]`
_ymin	OBGrid	`[protected]`
_zmax	OBGrid	`[protected]`
_zmin	OBGrid	`[protected]`
BeginData()	OBBase	`[inline]`
CastAndClear(bool clear=true)	OBBase	`[inline]`
cell	OBProxGrid	`[protected]`
ClassDescription()	OBBase	`[inline, static]`
Clear()	OBBase	`[virtual]`
DataSize() const	OBBase	`[inline]`
DeleteData(unsigned int type)	OBBase
DeleteData(OBGenericData *)	OBBase
DeleteData(std::vector< OBGenericData * > &)	OBBase
DoTransformations(const std::map< std::string, std::string > *)	OBBase	`[inline, virtual]`
EndData()	OBBase	`[inline]`
GetData(const unsigned int type)	OBBase
GetData(const std::string &)	OBBase
GetData(const char *)	OBBase
GetData()	OBBase	`[inline]`
GetData(DataOrigin source)	OBBase
GetProxVector(double, double, double)	OBProxGrid
GetProxVector(double *)	OBProxGrid
GetXmax() const	OBGrid	`[inline]`
GetXmin() const	OBGrid	`[inline]`
GetYmax() const	OBGrid	`[inline]`
GetYmin() const	OBGrid	`[inline]`
GetZmax() const	OBGrid	`[inline]`
GetZmin() const	OBGrid	`[inline]`
HasData(const std::string &)	OBBase
HasData(const char *)	OBBase
HasData(const unsigned int type)	OBBase
Init(OBMol &box)	OBGrid	`[virtual]`
LipoGrid()	OBProxGrid	`[inline]`
OBGrid()	OBGrid	`[inline]`
OBProxGrid(int gridtype=0)	OBProxGrid	`[inline]`
PointIsInBox(double x, double y, double z)	OBGrid	`[inline]`
PointIsInBox(double *c)	OBGrid	`[inline]`
PolarGrid()	OBProxGrid	`[inline]`
SetData(OBGenericData *d)	OBBase	`[inline]`
SetGridType(int gridtype)	OBProxGrid	`[inline]`
Setup(OBMol &mol, OBMol &box, double cutoff, double resolution=0.5)	OBProxGrid
Setup(OBMol &mol, OBMol &box, double cutoff, std::vector< bool > &use, double resolution=0.5)	OBProxGrid
~OBBase()	OBBase	`[inline, virtual]`
~OBProxGrid()	OBProxGrid	`[inline]`