Make it possible to use FEP lambda states as a reaction coordinate in AWH. Atom masse...

[alexxy/gromacs.git] / src / gromacs / mdlib / enerdata_utils.cpp

diff --git a/src/gromacs/mdlib/enerdata_utils.cpp b/src/gromacs/mdlib/enerdata_utils.cpp
index 5408847868067ddb3f186690ce04ff82acf517a5..8f7cf633a9ca79d09220381daa55b51e143c2301 100644 (file)
--- a/src/gromacs/mdlib/enerdata_utils.cpp
+++ b/src/gromacs/mdlib/enerdata_utils.cpp
@@ -53,7 +53,7 @@ ForeignLambdaTerms::ForeignLambdaTerms(int numLambdas) :
 {
 }
 
-std::pair<std::vector<double>, std::vector<double>> ForeignLambdaTerms::getTerms(t_commrec* cr) const
+std::pair<std::vector<double>, std::vector<double>> ForeignLambdaTerms::getTerms(const t_commrec* cr) const
 {
     GMX_RELEASE_ASSERT(finalizedPotentialContributions_,
                        "The object needs to be finalized before calling getTerms");