settle_gpu.cpp File Reference

#include "gmxpre.h"
#include "settle_gpu.h"
#include <cassert>
#include <cmath>
#include <cstdio>
#include <algorithm>
#include "gromacs/gpu_utils/devicebuffer.h"
#include "gromacs/gpu_utils/gputraits.h"
#include "gromacs/math/functions.h"
#include "gromacs/math/vec.h"
#include "gromacs/mdlib/constraint_gpu_helpers.h"
#include "gromacs/mdlib/settle_gpu_internal.h"
#include "gromacs/pbcutil/pbc.h"

Include dependency graph for settle_gpu.cpp:

Description

Implements SETTLE using GPU.

This file contains implementation for the data management of GPU version of SETTLE constraints algorithm.

Author

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