Gromacs
2021.6
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#include <tuple>
#include "gromacs/gpu_utils/devicebuffer_datatype.h"
#include "gromacs/gpu_utils/gpu_utils.h"
#include "gromacs/math/vectypes.h"
#include "gromacs/mdtypes/simulation_workload.h"
#include "gromacs/utility/arrayref.h"
#include "gromacs/utility/classhelpers.h"
#include "locality.h"
Declaration of interfaces for GPU state data propagator object.
This object stores and manages positions, velocities and forces for all particles in the system on the GPU.
Add cycle counters.
Add synchronization points.