#include <gromacs/mdlib/nbnxn_ocl/nbnxn_ocl_types.h>

Description

Pair list data.

Public Attributes
int	na_c
	number of atoms per cluster

int	nsci
	size of sci, # of i clusters in the list

int	sci_nalloc
	allocation size of sci

cl_mem	sci
	list of i-cluster ("super-clusters"). More...

int	ncj4
	total # of 4*j clusters

int	cj4_nalloc
	allocation size of cj4

cl_mem	cj4
	4*j cluster list, contains j cluster number and index into the i cluster list. More...

cl_mem	excl
	atom interaction bits It contains elements of type nbnxn_excl_t

int	nexcl
	count for excl

int	excl_nalloc
	allocation size of excl

cl_bool	bDoPrune
	true if pair-list pruning needs to be done during the current step

Member Data Documentation

cl_mem cl_plist::cj4

4*j cluster list, contains j cluster number and index into the i cluster list.

It contains elements of type nbnxn_cj4_t

cl_mem cl_plist::sci

list of i-cluster ("super-clusters").

It contains elements of type nbnxn_sci_t

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