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gmx::DomainDecompositionBuilder Class Reference

#include <gromacs/domdec/builder.h>

Description

Builds a domain decomposition management object.

This multi-phase construction needs first a decision about the duty(s) of each rank, and then perhaps to be advised of GPU streams for transfer operations.

Classes

class  Impl
 Impl class for DD builder. More...
 

Public Member Functions

 DomainDecompositionBuilder (const MDLogger &mdlog, t_commrec *cr, const DomdecOptions &options, const MdrunOptions &mdrunOptions, const gmx_mtop_t &mtop, const t_inputrec &ir, const MDModulesNotifiers &notifiers, const matrix box, ArrayRef< const RangePartitioning > updateGroupingPerMoleculeType, bool useUpdateGroups, real maxUpdateGroupRadius, ArrayRef< const RVec > xGlobal, bool useGpuForNonbonded, bool useGpuForPme, bool useGpuForUpdate, bool *useGpuDirectHalo, bool canUseGpuPmeDecomposition)
 Constructor.
 
 ~DomainDecompositionBuilder ()
 Destructor.
 
gmx_domdec_t * build (LocalAtomSetManager *atomSets, const gmx_localtop_t &localTopology, const t_state &localState, ObservablesReducerBuilder *observablesReducerBuilder)
 Build the resulting DD manager.
 

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