OpenMS
PenaltyFactors Struct Reference

Class for the penalty factors used during the optimization. More...

#include <OpenMS/TRANSFORMATIONS/RAW2PEAK/OptimizePick.h>

Inheritance diagram for PenaltyFactors:
[legend]
Collaboration diagram for PenaltyFactors:
[legend]

Public Member Functions

 PenaltyFactors ()
 
 PenaltyFactors (const PenaltyFactors &p)
 
PenaltyFactorsoperator= (const PenaltyFactors &p)
 
 ~PenaltyFactors ()
 

Public Attributes

double pos
 Penalty factor for the peak shape's position. More...
 
double lWidth
 Penalty factor for the peak shape's left width parameter. More...
 
double rWidth
 Penalty factor for the peak shape's right width parameter. More...
 

Detailed Description

Class for the penalty factors used during the optimization.

A great deviation (squared deviation) of a peak shape's position or its left or right width parameter can be penalised. In each iteration the penalty (for each peak shape) is computed by: penalty = penalty_pos * pow(p_position - old_position, 2) + penalty_lwidth * pow(p_width_l - old_width_l, 2) + penalty_rwidth * pow(p_width_r - old_width_r, 2);

Constructor & Destructor Documentation

◆ PenaltyFactors() [1/2]

PenaltyFactors ( )
inline

◆ PenaltyFactors() [2/2]

PenaltyFactors ( const PenaltyFactors p)
inline

◆ ~PenaltyFactors()

~PenaltyFactors ( )
inline

Member Function Documentation

◆ operator=()

Member Data Documentation

◆ lWidth

double lWidth

Penalty factor for the peak shape's left width parameter.

Referenced by PenaltyFactors::operator=(), PenaltyFactorsIntensity::operator=(), and TwoDOptimization::setPenalties().

◆ pos

double pos

Penalty factor for the peak shape's position.

Referenced by PenaltyFactors::operator=(), PenaltyFactorsIntensity::operator=(), and TwoDOptimization::setPenalties().

◆ rWidth

double rWidth

Penalty factor for the peak shape's right width parameter.

Referenced by PenaltyFactors::operator=(), PenaltyFactorsIntensity::operator=(), and TwoDOptimization::setPenalties().