Constructor for t_mde_delta_h_coll

[alexxy/gromacs.git] / src / gromacs / mdlib / energyoutput.h

diff --git a/src/gromacs/mdlib/energyoutput.h b/src/gromacs/mdlib/energyoutput.h
index 1adbc1c8277dd4e1de42b5fb26e72957deb24cc6..e7a91dec5dc2e18d896bf7b01118d014e5f05d90 100644 (file)
--- a/src/gromacs/mdlib/energyoutput.h
+++ b/src/gromacs/mdlib/energyoutput.h
@@ -413,7 +413,7 @@ private:
     //! Energy components for dhdl.xvg output
     std::vector<double> dE_;
     //! The delta U components (raw data + histogram)
-    t_mde_delta_h_coll* dhc_ = nullptr;
+    std::unique_ptr<t_mde_delta_h_coll> dhc_;
     //! Temperatures for simulated tempering groups
     std::vector<real> temperatures_;