Gromacs
2024.4
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#include "gmxpre.h"
#include "gromacs/gpu_utils/device_stream.h"
#include "gromacs/gpu_utils/devicebuffer_datatype.h"
#include "gromacs/gpu_utils/gputraits.h"
#include "gromacs/math/matrix.h"
Declares GPU implementations of backend-specific update-constraints functions.
Classes | |
struct | gmx::ScalingMatrix |
Scaling matrix struct. More... | |
Functions | |
void | gmx::launchScaleCoordinatesKernel (int numAtoms, DeviceBuffer< Float3 > d_coordinates, const ScalingMatrix &mu, const DeviceStream &deviceStream) |
Launches positions of velocities scaling kernel. More... | |