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fix_set_force_cuda.h
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Tue, Jul 16, 08:11

fix_set_force_cuda.h

/* ----------------------------------------------------------------------
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 FIX_CLASS
FixStyle(setforce/cuda,FixSetForceCuda)
#else
#ifndef LMP_FIX_SET_FORCE_CUDA_H
#define LMP_FIX_SET_FORCE_CUDA_H
#include "fix.h"
#include "cuda_data.h"
namespace LAMMPS_NS {
class FixSetForceCuda : public Fix {
public:
FixSetForceCuda(class LAMMPS *, int, char **);
int setmask();
void init();
void setup(int);
void min_setup(int);
void post_force(int);
void post_force_respa(int, int, int);
void min_post_force(int);
double compute_vector(int);
private:
class Cuda *cuda;
int flagx,flagy,flagz;
double xvalue,yvalue,zvalue;
double foriginal[3],foriginal_all[3];
cCudaData<double , F_FLOAT , x>* cu_foriginal;
int force_flag;
int nlevels_respa;
};
}
#endif
#endif

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