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verlet_cuda.h
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Thu, Dec 12, 10:53
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Sat, Dec 14, 10:53 (1 d, 21 h)
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rLAMMPS lammps
verlet_cuda.h
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/* ----------------------------------------------------------------------
LAMMPS - Large-scale Atomic/Molecular Massively Parallel Simulator
Original Version:
http://lammps.sandia.gov, Sandia National Laboratories
Steve Plimpton, sjplimp@sandia.gov
See the README file in the top-level LAMMPS directory.
-----------------------------------------------------------------------
USER-CUDA Package and associated modifications:
https://sourceforge.net/projects/lammpscuda/
Christian Trott, christian.trott@tu-ilmenau.de
Lars Winterfeld, lars.winterfeld@tu-ilmenau.de
Theoretical Physics II, University of Technology Ilmenau, Germany
See the README file in the USER-CUDA directory.
This software is distributed under the GNU General Public License.
------------------------------------------------------------------------- */
#ifdef INTEGRATE_CLASS
IntegrateStyle
(
verlet
/
cuda
,
VerletCuda
)
#else
#ifndef LMP_VERLET_CUDA_H
#define LMP_VERLET_CUDA_H
#include "verlet.h"
#include "modify_cuda.h"
namespace
LAMMPS_NS
{
class
VerletCuda
:
public
Verlet
{
public:
VerletCuda
(
class
LAMMPS
*
,
int
,
char
**
);
void
setup
();
void
setup_minimal
(
int
);
void
run
(
int
);
void
test_atom
(
int
atom
,
char
*
astring
);
//debugging purpose
int
dotestatom
;
//debugging purpose
protected:
class
Cuda
*
cuda
;
void
force_clear
();
double
time_pair
;
double
time_kspace
;
double
time_comm
;
double
time_modify
;
double
time_fulliterate
;
ModifyCuda
*
modify_cuda
;
};
}
#endif
#endif
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