Gromacs  2020.4
 All Classes Namespaces Files Functions Variables Typedefs Enumerations Enumerator Friends Macros Groups Pages
Functions
leapfrogtestrunners.cpp File Reference
#include "gmxpre.h"
#include "leapfrogtestrunners.h"
#include "config.h"
#include <assert.h>
#include <cmath>
#include <algorithm>
#include <unordered_map>
#include <vector>
#include "gromacs/math/vec.h"
#include "gromacs/math/vectypes.h"
#include "gromacs/mdlib/gmx_omp_nthreads.h"
#include "gromacs/mdlib/update.h"
#include "gromacs/mdtypes/group.h"
#include "gromacs/mdtypes/mdatom.h"
#include "gromacs/utility/arrayref.h"
#include "testutils/testasserts.h"
#include "leapfrogtestdata.h"
+ Include dependency graph for leapfrogtestrunners.cpp:

Description

Runner for CPU-based implementation of the integrator.

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

Functions

void gmx::test::integrateLeapFrogSimple (LeapFrogTestData *testData, int numSteps)
 Integrate using CPU version of Leap-Frog. More...