gmx::cellInfo Struct Reference

#include <gromacs/mdlib/gpuforcereduction_impl.h>

Description

structure to hold cell information for any nbat-format forces

Public Attributes
const int *	cell = nullptr
	cell index mapping for any nbat-format forces
DeviceBuffer< int >	d_cell
	device copy of cell index mapping for any nbat-format forces
int	cellSize = -1
	number of atoms in cell array
int	cellSizeAlloc = -1
	number of atoms allocated in cell array

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The documentation for this struct was generated from the following file:

• src/gromacs/mdlib/gpuforcereduction_impl.h