Finish removing t_mdatoms from update module

[alexxy/gromacs.git] / src / gromacs / mdrun / md.cpp

diff --git a/src/gromacs/mdrun/md.cpp b/src/gromacs/mdrun/md.cpp
index f5db890f8963a62adc30faf73542712e510cc34a..df33e9e78205f8be58675f6200d408f1c63430a8 100644 (file)
--- a/src/gromacs/mdrun/md.cpp
+++ b/src/gromacs/mdrun/md.cpp
@@ -1609,7 +1609,8 @@ void gmx::LegacySimulator::do_md()
                                           constr,
                                           do_log,
                                           do_ene);
-                upd.finish_update(*ir, mdatoms, state, wcycle, constr != nullptr);
+                upd.finish_update(
+                        *ir, mdatoms->havePartiallyFrozenAtoms, mdatoms->homenr, state, wcycle, constr != nullptr);
             }
 
             if (ir->bPull && ir->pull->bSetPbcRefToPrevStepCOM)