Translate and rotate an atom on a 2D hypersphere-surface. More...

#include <move.h>

Inheritance diagram for Faunus::move::TranslateRotate:

Collaboration diagram for Faunus::move::TranslateRotate:

Public Member Functions
	TranslateRotate (Space &spc)

Public Member Functions inherited from Faunus::move::Move
void	from_json (const json &j)

void	to_json (json &j) const
	JSON report w. statistics, output etc.

void	move (Change &change)
	Perform move and modify given change object.

void	accept (Change &change)

void	reject (Change &change)

void	setRepeat (int repeat)

virtual double	bias (Change &change, double old_energy, double new_energy)
	Extra energy not captured by the Hamiltonian. More...

	Move (Space &spc, std::string_view name, std::string_view cite)

bool	isStochastic () const
	True if move should be called stochastically.

const std::string &	getName () const

Protected Types
using	OptionalGroup = std::optional< std::reference_wrapper< Space::GroupType > >

Protected Member Functions
void	_to_json (json &j) const override
	Extra info for report if needed.

	TranslateRotate (Space &spc, std::string name, std::string cite)

Protected Attributes
int	molid = -1
	Molecule ID of the molecule(s) to move.

Protected Attributes inherited from Faunus::move::Move
const std::string	name
	Name of move.

Space &	spc
	Space to operate on.

int	repeat = 1

unsigned long	number_of_attempted_moves = 0
	Counter for total number of move attempts.

Additional Inherited Members
Static Public Attributes inherited from Faunus::move::Move
static Random	slump
	Shared for all moves.

Detailed Description

Translate and rotate an atom on a 2D hypersphere-surface.

Translate and rotate a molecular group

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

Public Member Functions