Move computeSlowForces into stepWork

[alexxy/gromacs.git] / src / gromacs / listed_forces / gpubonded_impl.cpp

diff --git a/src/gromacs/listed_forces/gpubonded_impl.cpp b/src/gromacs/listed_forces/gpubonded_impl.cpp
index af62aac7a0a6f2c257f58d348d105af71a196c0f..ff6232572373ab96a699cf5bd32acb599e548dbf 100644 (file)
--- a/src/gromacs/listed_forces/gpubonded_impl.cpp
+++ b/src/gromacs/listed_forces/gpubonded_impl.cpp
@@ -149,6 +149,10 @@ bool inputSupportsGpuBondeds(const t_inputrec& ir, const gmx_mtop_t& mtop, std::
     {
         errorReasons.emplace_back("MiMiC");
     }
+    if (ir.useMts)
+    {
+        errorReasons.emplace_back("Cannot run with multiple time stepping");
+    }
     if (ir.opts.ngener > 1)
     {
         errorReasons.emplace_back("Cannot run with multiple energy groups");