GetProxVector(double, double, double) | OBProxGrid | |
GetProxVector(double *) | OBProxGrid | |
LipoGrid() | OBProxGrid | [inline] |
OBProxGrid(int gridtype=0) | OBProxGrid | [inline] |
PointIsInBox(double x, double y, double z) | OBProxGrid | [inline] |
PolarGrid() | OBProxGrid | [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 | |
~OBProxGrid() | OBProxGrid | [inline] |