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VolMapCreateILS Member List

This is the complete list of members for VolMapCreateILS, including all inherited members.
add_map_to_molecule()VolMapCreateILS
compute()VolMapCreateILS
get_conformers(float *&conform) constVolMapCreateILS [inline]
get_statistics(int &numconf, int &numorient, int &numrot)VolMapCreateILS [inline]
get_volmap()VolMapCreateILS [inline]
set_alignsel(AtomSel *asel)VolMapCreateILS
set_maxenergy(float maxenergy)VolMapCreateILS
set_minmax(float minx, float miny, float minz, float maxx, float maxy, float maxz)VolMapCreateILS
set_pbc(float center[3], int bbox)VolMapCreateILS
set_probe(int num_probe_atoms, int num_conf, const float *probe_coords, const float *vdwrmin, const float *vdweps, const float *charge)VolMapCreateILS
set_probe_symmetry(int order1, const float *axis1, int order2, const float *axis2, int tetrahedral)VolMapCreateILS
set_transform(const Matrix4 *mat)VolMapCreateILS
VolMapCreateILS(VMDApp *_app, int molid, int firstframe, int lastframe, float T, float res, int subr, float cut, int maskonly)VolMapCreateILS
write_map(const char *filename)VolMapCreateILS
~VolMapCreateILS()VolMapCreateILS

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