boxdeformation.h File Reference

#include <memory>
#include "gromacs/math/vectypes.h"
#include "gromacs/utility/arrayref.h"
#include "gromacs/utility/basedefinitions.h"
#include "gromacs/utility/classhelpers.h"

Include dependency graph for boxdeformation.h:

Description

Declares interface to box deformation code.

Author

Mark Abraham mark..nosp@m.j.ab.nosp@m.raham.nosp@m.@gma.nosp@m.il.co.nosp@m.m

Functions
std::unique_ptr< BoxDeformation >	gmx::prepareBoxDeformation (const matrix &initialBox, t_commrec *cr, const t_inputrec &inputrec)
	Factory function for box deformation module. More...