src/gromacs/trajectory/energy.h

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  37 #ifndef GMX_TRAJECTORY_ENERGY_H
  38 #define GMX_TRAJECTORY_ENERGY_H
  39
  40 #include "gromacs/utility/real.h"
  41
  42 struct t_energy {
  43     //! The current energy.
  44     real   e;
  45     //! The running average of the energy
  46     double eav;
  47     //! The sum of energies until now.
  48     double esum;
  49 };
  50
  51 #endif