Make non bonded energy terms enum class

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

diff --git a/src/gromacs/listed_forces/pairs.cpp b/src/gromacs/listed_forces/pairs.cpp
index 77c78746fddb9ad54a2b70c84672fc82df963d59..f84fe890abbe35410078b102d070f45a1a8844e0 100644 (file)
--- a/src/gromacs/listed_forces/pairs.cpp
+++ b/src/gromacs/listed_forces/pairs.cpp
@@ -376,12 +376,12 @@ static real do_pairs_general(int                 ftype,
     {
         case F_LJ14:
         case F_LJC14_Q:
-            energygrp_elec = grppener->ener[egCOUL14].data();
-            energygrp_vdw  = grppener->ener[egLJ14].data();
+            energygrp_elec = grppener->energyGroupPairTerms[NonBondedEnergyTerms::Coulomb14].data();
+            energygrp_vdw  = grppener->energyGroupPairTerms[NonBondedEnergyTerms::LJ14].data();
             break;
         case F_LJC_PAIRS_NB:
-            energygrp_elec = grppener->ener[egCOULSR].data();
-            energygrp_vdw  = grppener->ener[egLJSR].data();
+            energygrp_elec = grppener->energyGroupPairTerms[NonBondedEnergyTerms::CoulombSR].data();
+            energygrp_vdw  = grppener->energyGroupPairTerms[NonBondedEnergyTerms::LJSR].data();
             break;
         default:
             energygrp_elec = nullptr; /* Keep compiler happy */