Inheritance diagram for mcpele::AdaptiveTakeStep:

Public Member Functions
virtual	~AdaptiveTakeStep ()
	AdaptiveTakeStep (std::shared_ptr< TakeStep > ts, const size_t interval=100, const double factor=0.9, const double min_acceptance_ratio=0.2, const double max_acceptance_ratio=0.5)
void	displace (pele::Array< double > &coords, MC *mc)
void	report (pele::Array< double > &old_coords, const double old_energy, pele::Array< double > &new_coords, const double new_energy, const bool success, MC *mc)
double	get_min_acceptance_ratio () const
double	get_max_acceptance_ratio () const
Protected Attributes
std::shared_ptr< TakeStep >	m_ts
size_t	m_interval
size_t	m_total_steps
size_t	m_accepted_steps
const double	m_factor
const double	m_min_acceptance_ratio
const double	m_max_acceptance_ratio

Detailed Description

Definition at line 8 of file adaptive_takestep.h.

Constructor & Destructor Documentation

virtual mcpele::AdaptiveTakeStep::~AdaptiveTakeStep ( ) [inline, virtual]

Definition at line 18 of file adaptive_takestep.h.

mcpele::AdaptiveTakeStep::AdaptiveTakeStep	(	std::shared_ptr< TakeStep >	ts,
		const size_t	interval = `100`,
		const double	factor = `0.9`,
		const double	min_acceptance_ratio = `0.2`,
		const double	max_acceptance_ratio = `0.5`
	)

Definition at line 5 of file adaptive_takestep.cpp.

void mcpele::AdaptiveTakeStep::displace	(	pele::Array< double > &	coords,
		MC *	mc
	)		`[inline, virtual]`

Definition at line 22 of file adaptive_takestep.h.

double mcpele::AdaptiveTakeStep::get_max_acceptance_ratio ( ) const [inline]

Definition at line 27 of file adaptive_takestep.h.

double mcpele::AdaptiveTakeStep::get_min_acceptance_ratio ( ) const [inline]

Definition at line 26 of file adaptive_takestep.h.

void mcpele::AdaptiveTakeStep::report	(	pele::Array< double > &	old_coords,
		const double	old_energy,
		pele::Array< double > &	new_coords,
		const double	new_energy,
		const bool	success,
		MC *	mc
	)		`[virtual]`