Refactor virtual site interface

[alexxy/gromacs.git] / src / gromacs / gmxpreprocess / grompp.cpp

diff --git a/src/gromacs/gmxpreprocess/grompp.cpp b/src/gromacs/gmxpreprocess/grompp.cpp
index 93e2fc4c00b3d8c1e212484df8e682098af878b2..84c5d9932861bc66db36327a4b195ec679eea182 100644 (file)
--- a/src/gromacs/gmxpreprocess/grompp.cpp
+++ b/src/gromacs/gmxpreprocess/grompp.cpp
@@ -1623,7 +1623,7 @@ static void set_verlet_buffer(const gmx_mtop_t*    mtop,
     ir->rlist = calcVerletBufferSize(*mtop, det(box), *ir, ir->nstlist, ir->nstlist - 1,
                                      buffer_temp, listSetup4x4);
 
-    const int n_nonlin_vsite = countNonlinearVsites(*mtop);
+    const int n_nonlin_vsite = gmx::countNonlinearVsites(*mtop);
     if (n_nonlin_vsite > 0)
     {
         std::string warningMessage = gmx::formatString(