Add lambda state to dhdl.xvg with AWH fep

[alexxy/gromacs.git] / src / gromacs / mdlib / tests / energyoutput.cpp

diff --git a/src/gromacs/mdlib/tests/energyoutput.cpp b/src/gromacs/mdlib/tests/energyoutput.cpp
index 66817384e98c3ebacfcc52c61b4fb20444ac76b2..51aed47c64def29dd2bdbc518983c654fada1b64 100644 (file)
--- a/src/gromacs/mdlib/tests/energyoutput.cpp
+++ b/src/gromacs/mdlib/tests/energyoutput.cpp
@@ -362,7 +362,7 @@ public:
         // TODO This object will always return zero as RMSD value.
         //      It is more relevant to have non-zero value for testing.
         constraints_ = makeConstraints(
-                mtop_, inputrec_, nullptr, false, nullptr, &cr_, false, nullptr, nullptr, nullptr, false);
+                mtop_, inputrec_, nullptr, false, nullptr, &cr_, false, nullptr, nullptr, nullptr, false, nullptr);
     }
 
     /*! \brief Helper function to generate synthetic data to output
@@ -615,7 +615,6 @@ TEST_P(EnergyOutputTest, CheckOutput)
                                           tmass_,
                                           enerdata_.get(),
                                           nullptr,
-                                          nullptr,
                                           box_,
                                           PTCouplingArrays({ state_.boxv,
                                                              state_.nosehoover_xi,