Gromacs  2025.0-dev-20241009-5c23d5f
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lincs_gpu.h File Reference
#include <memory>
#include "gromacs/gpu_utils/device_context.h"
#include "gromacs/gpu_utils/device_stream.h"
#include "gromacs/gpu_utils/devicebuffer_datatype.h"
#include "gromacs/gpu_utils/gputraits.h"
#include "gromacs/mdlib/constr.h"
#include "gromacs/pbcutil/pbc_aiuc.h"
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Description

Declares the class for GPU implementation of LINCS.

Author
Artem Zhmurov zhmur.nosp@m.ov@g.nosp@m.mail..nosp@m.com

Classes

struct  gmx::AtomPair
 A pair of atoms indexes. More...
 
class  gmx::LincsGpu
 Class with interfaces and data for GPU version of LINCS. More...