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gmx::MDModulesEnergyOutputToNNPotRequestChecker Struct Reference

#include <gromacs/mdrunutility/mdmodulesnotifiers.h>

Description

Check if NNPot module outputs energy to a specific field.

Ensures that energy is output for NNPot module.

Public Attributes

bool energyOutputToNNPot_ = false
 Trigger output to NNPot energy field.
 

The documentation for this struct was generated from the following file: