Gromacs
2020.4
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#include <memory>
#include <vector>
#include "gromacs/math/vec.h"
#include "gromacs/math/vectypes.h"
#include "gromacs/utility/alignedallocator.h"
#include "gromacs/utility/arrayref.h"
#include "gromacs/utility/range.h"
#include "grid.h"
#include "gridsetdata.h"
Declares the GridSet class.
This class holds the grids for the local and non-local domain decomposition zones, as well as the cell and atom data that covers all grids.
Classes | |
class | Nbnxm::GridSet |
Holds a set of search grids for the local + non-local DD zones. More... | |
struct | Nbnxm::GridSet::DomainSetup |
Description of the domain setup: PBC and the connections between domains. More... | |