UnitCellInfo Struct Reference

#include <gromacs/domdec/domdec_struct.h>

Description

Provides information about properties of the unit cell.

Public Member Functions
	UnitCellInfo (const t_inputrec &ir)
	Constructor.

Public Attributes
int	npbcdim
	We have PBC from dim 0 (X) up to npbcdim.
int	numBoundedDimensions
	The system is bounded from 0 (X) to numBoundedDimensions.
bool	ddBoxIsDynamic
	Tells whether the box bounding the atoms is dynamic.
bool	haveScrewPBC
	Screw PBC?

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

• src/gromacs/domdec/domdec_struct.h
• src/gromacs/domdec/domdec.cpp