ObservablesHistory Struct Reference

#include <gromacs/mdtypes/observableshistory.h>

Description

Observables history, for writing/reading to/from checkpoint file.

Public Member Functions
	ObservablesHistory ()
	Default constructor.
	~ObservablesHistory ()
	Default destructor.

Public Attributes
std::unique_ptr< energyhistory_t >	energyHistory
	History for energy observables, used for output only.
std::unique_ptr< edsamhistory_t >	edsamHistory
	Essential dynamics and flooding history.
std::unique_ptr< swaphistory_t >	swapHistory
	Ion/water position swapping history.

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

• src/gromacs/mdtypes/observableshistory.h
• src/gromacs/mdtypes/observableshistory.cpp