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NAMD
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This is the complete list of members for GridforceGrid, including all inherited members.
| compute_VdV(Position pos, float &V, Vector &dV) const | GridforceGrid | inline |
| fits_lattice(const Lattice &lattice) | GridforceGrid | |
| get_all_gridvals(float **all_gridvals) const =0 | GridforceGrid | pure virtual |
| get_center(void) const =0 | GridforceGrid | pure virtual |
| get_checksize(void) const =0 | GridforceGrid | pure virtual |
| get_corner(int idx) | GridforceGrid | protected |
| get_e(void) const =0 | GridforceGrid | pure virtual |
| get_grid_type(void) | GridforceGrid | inline |
| get_inv(void) const =0 | GridforceGrid | pure virtual |
| get_k0(void) const =0 | GridforceGrid | pure virtual |
| get_k1(void) const =0 | GridforceGrid | pure virtual |
| get_k2(void) const =0 | GridforceGrid | pure virtual |
| get_origin(void) const =0 | GridforceGrid | pure virtual |
| get_scale(void) const =0 | GridforceGrid | pure virtual |
| get_total_grids(void) const =0 | GridforceGrid | pure virtual |
| GridforceGrid() | GridforceGrid | inlineprotected |
| GridforceGridType enum name | GridforceGrid | |
| GridforceGridTypeFull enum value | GridforceGrid | |
| GridforceGridTypeLite enum value | GridforceGrid | |
| GridforceGridTypeUndefined enum value | GridforceGrid | |
| initialize(char *potfilename, SimParameters *simParams, MGridforceParams *mgridParams)=0 | GridforceGrid | pure virtual |
| mygridnum | GridforceGrid | protected |
| new_grid(int gridnum, char *potfilename, SimParameters *simParams, MGridforceParams *mgridParams) | GridforceGrid | static |
| pack(MOStream *msg) const =0 | GridforceGrid | protectedpure virtual |
| pack_grid(GridforceGrid *grid, MOStream *msg) | GridforceGrid | static |
| reinitialize(SimParameters *simParams, MGridforceParams *mgridParams)=0 | GridforceGrid | pure virtual |
| set_all_gridvals(float *all_gridvals, long int sz)=0 | GridforceGrid | pure virtual |
| set_scale(Vector s)=0 | GridforceGrid | pure virtual |
| type | GridforceGrid | protected |
| unpack(MIStream *msg)=0 | GridforceGrid | protectedpure virtual |
| unpack_grid(int gridnum, MIStream *msg) | GridforceGrid | static |
| wrap_position(const Position &pos, const Lattice &lattice) | GridforceGrid | inline |
| ~GridforceGrid() | GridforceGrid | virtual |
1.8.5