Add lambda state to dhdl.xvg with AWH fep

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

diff --git a/src/gromacs/mdrun/md.cpp b/src/gromacs/mdrun/md.cpp
index 4f6f0263f27a5faab674c33718711b7148cbfeda..0a59a4f2535bca973a34366ef336b2dce519ee23 100644 (file)
--- a/src/gromacs/mdrun/md.cpp
+++ b/src/gromacs/mdrun/md.cpp
@@ -1831,7 +1831,6 @@ void gmx::LegacySimulator::do_md()
                                                  md->tmass,
                                                  enerd,
                                                  ir->fepvals.get(),
-                                                 ir->expandedvals.get(),
                                                  lastbox,
                                                  PTCouplingArrays{ state->boxv,
                                                                    state->nosehoover_xi,