Gromacs
2025-dev-20241003-bd59e46
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#include <memory>
#include "gromacs/math/vectypes.h"
#include "gromacs/mdtypes/enerdata.h"
#include "gromacs/mdtypes/threaded_force_buffer.h"
#include "gromacs/utility/arrayref.h"
#include "gromacs/utility/real.h"
Declares the free-energy kernel dispatch class.
Classes | |
class | gmx::ArrayRefWithPadding< typename > |
Interface to a C array of T (or part of a std container of T), that includes padding that is suitable for the kinds of SIMD operations GROMACS uses. More... | |
class | gmx::FreeEnergyDispatch |
Temporary data and methods for handling dispatching of the nbnxm free-energy kernels. More... | |