ssd Struct Reference

#include <ssd.h>

Public Member Functions
void	print () const
	ssd ()
void	operator() (model &m, const precalculate &p, const igrid &ig, output_type &out, change &g, const vec &v) const

Public Attributes
unsigned	evals
fl	initial_factor
fl	min_factor
fl	up
fl	down

Constructor & Destructor Documentation

ssd::ssd ( )

inline

Member Function Documentation

void ssd::print ( ) const

inline

References down, evals, initial_factor, min_factor, and up.

Referenced by manifold::print().

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void ssd::operator()	(	model &	m,
		const precalculate &	p,
		const igrid &	ig,
		output_type &	out,
		change &	g,
		const vec &	v
	)		const

References output_type::c, output_type::coords, down, output_type::e, model::eval_deriv(), evals, model::get_heavy_atom_movable_coords(), conf::increment(), initial_factor, min_factor, up, and VINA_U_FOR.

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Member Data Documentation

unsigned ssd::evals

Referenced by do_search(), main_procedure(), operator()(), monte_carlo::operator()(), manifold::operator()(), print(), and monte_carlo::single_run().

fl ssd::initial_factor

Referenced by operator()(), and print().

fl ssd::min_factor

Referenced by operator()(), and print().

fl ssd::up

Referenced by operator()(), and print().

fl ssd::down

Referenced by operator()(), and print().

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

• ssd.h
• ssd.cpp