src/bond.c
@@ -29,11 +29,23 @@ blist->bond[blist->n - 1]->vtx1=vtx1; blist->bond[blist->n - 1]->vtx2=vtx2; blist->bond[blist->n - 1]->tainted=0; blist->bond[blist->n - 1]->idx=blist->n-1; //Should we calculate bond length NOW? return blist->bond[blist->n-1]; } ts_bool bond_vector(ts_bond *bond){ bond->x = bond->vtx1->x - bond->vtx2->x; bond->y = bond->vtx1->y - bond->vtx2->y; bond->z = bond->vtx1->z - bond->vtx2->z; return TS_SUCCESS; } ts_bool bond_list_free(ts_bond_list *blist){ ts_uint i; for(i=0;i<blist->n;i++){
