gmx::IMDModule Class Reference

#include <gromacs/mdtypes/imdmodule.h>

Inheritance diagram for gmx::IMDModule:

Description

Extension module for GROMACS simulations.

The methods that return other interfaces can in the future return null for those interfaces that the module does not need to implement, but currently the callers are not prepared to generically handle various cases.

Public Member Functions
virtual IMdpOptionProvider *	mdpOptionProvider ()=0
	Returns an interface for handling mdp input (and tpr I/O).
virtual IMDOutputProvider *	outputProvider ()=0
	Returns an interface for handling output files during simulation.
virtual void	initForceProviders (ForceProviders *forceProviders)=0
	Initializes force providers from this module.

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

• src/gromacs/mdtypes/imdmodule.h