Turn nbnxn_grid_t into a class

[alexxy/gromacs.git] / src / gromacs / nbnxm / pairlistset.h

diff --git a/src/gromacs/nbnxm/pairlistset.h b/src/gromacs/nbnxm/pairlistset.h
index d550537f5bf5e26fa792c90e96a82313dc701856..26e54c99a32313c8cb9a42a6529891814e732807 100644 (file)
--- a/src/gromacs/nbnxm/pairlistset.h
+++ b/src/gromacs/nbnxm/pairlistset.h
@@ -48,6 +48,14 @@
  *
  * TODO: Merge into the constructor
  */
+typedef void nbnxn_free_t (void *ptr);
+
+/* Tells if the pair-list corresponding to nb_kernel_type is simple.
+ * Returns FALSE for super-sub type pair-list.
+ */
+gmx_bool nbnxn_kernel_pairlist_simple(int nb_kernel_type);
+
+/* Initializes a set of pair lists stored in nbnxn_pairlist_set_t */
 void nbnxn_init_pairlist_set(nbnxn_pairlist_set_t *nbl_list);
 
 /*! \brief Prepare the list-set produced by the search for dynamic pruning