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Use array for term and foreign_term in gmx_enerdata_t
[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 1559acd0eb20541e2c03c33787b6627cfe45e5eb..07a26a1e8d83be8cb6899d6040c203842bd50fd0 100644
(file)
--- a/
src/gromacs/mdlib/enerdata_utils.cpp
+++ b/
src/gromacs/mdlib/enerdata_utils.cpp
@@
-234,7
+234,7
@@
void ForeignLambdaTerms::finalizePotentialContributions(gmx::ArrayRef<const doub
void accumulatePotentialEnergies(gmx_enerdata_t* enerd, gmx::ArrayRef<const real> lambda, const t_lambda* fepvals)
{
- sum_epot(enerd->grpp, enerd->term);
+ sum_epot(enerd->grpp, enerd->term
.data()
);
if (fepvals)
{