#include <gromacs/domdec/localatomsetmanager.h>

Description

Hands out handles to local atom set indices and triggers index recalculation for all sets upon domain decomposition if run in parallel.

Public Member Functions
LocalAtomSet	add (ArrayRef< const index > globalAtomIndex)
	Add a new atom set to be managed and give back a handle. More...

void	setIndicesInDomainDecomposition (const gmx_ga2la_t &ga2la)
	Recalculate local and collective indices from ga2la. Uses global atom to local atom lookup structure to update atom indices.

Member Function Documentation

template LocalAtomSet gmx::LocalAtomSetManager::add< void, void > ( ArrayRef< const index > globalAtomIndex )

Add a new atom set to be managed and give back a handle.

Parameters

[in] globalAtomIndex Indices of the atoms to be managed

The documentation for this class was generated from the following files: