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List of all members | Public Member Functions
gmx::Update Class Reference

#include <gromacs/mdlib/update.h>

Description

Contains data for update phase.

Public Member Functions

 Update (const t_inputrec *ir, BoxDeformation *boxDeformation)
 Constructor.
 
gmx_stochd_t * sd () const
 Returns handle to stochd_t struct.
 
PaddedVector< gmx::RVec > * xp ()
 Returns pointer to PaddedVector xp.
 
BoxDeformation * deform () const
 Returns handle to box deformation class.
 
void setNumAtoms (int nAtoms)
 Resizes xp.
 

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