mttk.h File Reference

#include <queue>
#include "modularsimulatorinterfaces.h"
#include "statepropagatordata.h"

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Description

Declares classes related to MTTK pressure coupling.

Author

Pascal Merz pasca.nosp@m.l.me.nosp@m.rz@me.nosp@m..com

This header is only used within the modular simulator module

Classes
struct	gmx::MttkPropagatorConnectionDetails
	Struct collecting the propagator tags and offsets used by the MTTK pressure coupling. More...
class	gmx::MttkData
	Class holding the extra dof and parameters used by the MTTK algorithm. More...
class	gmx::MttkPropagatorConnection
	Object holding the callbacks and scaling views for the connection of MTTKElement objects to propagators. More...
class	gmx::MttkElement
	Element propagating the MTTK degree of freedom. More...
class	gmx::MttkBoxScaling
	This element scales the box based on the MTTK dof. More...