statepropagatordata.h File Reference

#include <cstdio>
#include <memory>
#include <optional>
#include <string>
#include <vector>
#include "gromacs/gpu_utils/hostallocator.h"
#include "gromacs/math/arrayrefwithpadding.h"
#include "gromacs/math/paddedvector.h"
#include "gromacs/mdtypes/checkpointdata.h"
#include "gromacs/mdtypes/forcebuffers.h"
#include "gromacs/utility/basedefinitions.h"
#include "gromacs/utility/keyvaluetree.h"
#include "gromacs/utility/real.h"
#include "gromacs/utility/vectypes.h"
#include "modularsimulatorinterfaces.h"
#include "topologyholder.h"

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Description

Declares the state for the modular simulator.

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
class	gmx::CheckpointData< operation >
	} More...
class	gmx::ArrayRef< typename >
	STL-like interface to a C array of T (or part of a std container of T). More...
class	gmx::StatePropagatorData
	StatePropagatorData and associated data. More...
class	gmx::StatePropagatorData::Element
	Element for StatePropagatorData. More...