gmx::SimulatorStateData Struct Reference

#include <gromacs/mdrun/simulatorbuilder.h>

Collaboration diagram for gmx::SimulatorStateData:

Description

Data for a specific simulation state.

Todo:

Think of a better name and annoy people that forget to add documentation for their code.

Public Member Functions
	SimulatorStateData (t_state *globalState, t_state *localState, ObservablesHistory *observablesHistory, gmx_enerdata_t *enerdata, gmx_ekindata_t *ekindata)
	Build collection of current state data.
	SimulatorStateData (const SimulatorStateData &simulatorStateData)=default
	Can perform copy of current state.

Public Attributes
t_state *	globalState_p
	Handle to global state of the simulation.
t_state *	localState_p
	Handle to local state of the simulation.
ObservablesHistory *	observablesHistory_p
	Handle to current simulation history.
gmx_enerdata_t *	enerdata_p
	Handle to collected data for energy groups.
gmx_ekindata_t *	ekindata_p
	Handle to collected data for kinectic energy.

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

• src/gromacs/mdrun/simulatorbuilder.h