NbnxnPairlistCpuWork::IClusterData Struct Reference

#include <gromacs/nbnxm/pairlistwork.h>

Description

Struct for storing coordinats and bounding box for an i-entry during search.

Public Attributes
AlignedVector< Nbnxm::BoundingBox >	bb
	The bounding boxes, pbc shifted, for each cluster.
std::vector< real >	x
	The coordinates, pbc shifted, for each atom.
AlignedVector< real >	xSimd
	Aligned list for storing 4*DIM*GMX_SIMD_REAL_WIDTH reals.

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

• src/gromacs/nbnxm/pairlistwork.h