}
}
-void add_param(t_params *ps, int ai, int aj, const real *c, const char *s)
+void add_param(InteractionTypeParameters *ps, int ai, int aj, const real *c, const char *s)
{
int i;
ps->nr++;
}
-void add_imp_param(t_params *ps, int ai, int aj, int ak, int al, real c0, real c1,
+void add_imp_param(InteractionTypeParameters *ps, int ai, int aj, int ak, int al, real c0, real c1,
const char *s)
{
pr_alloc(1, ps);
ps->nr++;
}
-void add_dih_param(t_params *ps, int ai, int aj, int ak, int al, real c0, real c1,
+void add_dih_param(InteractionTypeParameters *ps, int ai, int aj, int ak, int al, real c0, real c1,
real c2, const char *s)
{
pr_alloc(1, ps);
ps->nr++;
}
-void add_cmap_param(t_params *ps, int ai, int aj, int ak, int al, int am, const char *s)
+void add_cmap_param(InteractionTypeParameters *ps, int ai, int aj, int ak, int al, int am, const char *s)
{
pr_alloc(1, ps);
ps->param[ps->nr].ai() = ai;
ps->nr++;
}
-void add_vsite2_atoms(t_params *ps, int ai, int aj, int ak)
+void add_vsite2_atoms(InteractionTypeParameters *ps, int ai, int aj, int ak)
{
pr_alloc(1, ps);
ps->param[ps->nr].ai() = ai;
ps->nr++;
}
-void add_vsite2_param(t_params *ps, int ai, int aj, int ak, real c0)
+void add_vsite2_param(InteractionTypeParameters *ps, int ai, int aj, int ak, real c0)
{
pr_alloc(1, ps);
ps->param[ps->nr].ai() = ai;
ps->nr++;
}
-void add_vsite3_param(t_params *ps, int ai, int aj, int ak, int al,
+void add_vsite3_param(InteractionTypeParameters *ps, int ai, int aj, int ak, int al,
real c0, real c1)
{
pr_alloc(1, ps);
ps->nr++;
}
-void add_vsite3_atoms(t_params *ps, int ai, int aj, int ak, int al, bool bSwapParity)
+void add_vsite3_atoms(InteractionTypeParameters *ps, int ai, int aj, int ak, int al, bool bSwapParity)
{
pr_alloc(1, ps);
ps->param[ps->nr].ai() = ai;
ps->nr++;
}
-void add_vsite4_atoms(t_params *ps, int ai, int aj, int ak, int al, int am)
+void add_vsite4_atoms(InteractionTypeParameters *ps, int ai, int aj, int ak, int al, int am)
{
pr_alloc(1, ps);
ps->param[ps->nr].ai() = ai;