VinaLC: Parallel Molecular Docking Program

Biochemical and Biophysical Systems Group
VinaLC version: 1.1.2

scoring_function Struct Referenceabstract

#include <scoring_function.h>

Inheritance diagram for scoring_function:

Public Member Functions

virtual atom_type::t atom_typing_used () const =0
 
virtual fl cutoff () const =0
 
virtual fl eval (sz t1, sz t2, fl r) const =0
 
virtual fl conf_independent (const model &m, fl e) const =0
 

Member Function Documentation

virtual atom_type::t scoring_function::atom_typing_used ( ) const
pure virtual

Implemented in weighted_terms.

virtual fl scoring_function::cutoff ( ) const
pure virtual

Implemented in weighted_terms.

virtual fl scoring_function::eval ( sz  t1,
sz  t2,
fl  r 
) const
pure virtual

Implemented in weighted_terms.

Referenced by precalculate::precalculate().

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virtual fl scoring_function::conf_independent ( const model m,
fl  e 
) const
pure virtual

Implemented in weighted_terms.

Referenced by do_search(), and model::eval_adjusted().

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