VinaLC: Parallel Molecular Docking Program

Biochemical and Biophysical Systems Group
VinaLC version: 1.1.2

quasi_newton Struct Reference

#include <quasi_newton.h>

Public Member Functions

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

Public Attributes

unsigned max_steps
 
fl average_required_improvement
 

Constructor & Destructor Documentation

quasi_newton::quasi_newton ( )
inline

Member Function Documentation

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

References average_required_improvement, bfgs(), output_type::c, output_type::e, and max_steps.

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Member Data Documentation

fl quasi_newton::average_required_improvement

Referenced by operator()().


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