VinaLC: Parallel Molecular Docking Program |
Biochemical and Biophysical Systems Group |
Public Member Functions | |
beads (sz reserve_size, fl radius_sqr_) | |
void | add (sz index, const vec &coords) |
Public Attributes | |
fl | radius_sqr |
std::vector< std::pair< vec, szv > > | data |
References data, radius_sqr, vec_distance_sqr(), and VINA_FOR_IN.
Referenced by model::assign_bonds().
std::vector<std::pair<vec, szv> > beads::data |
Referenced by add(), model::assign_bonds(), and beads().