ggl::chem::RRC_TState Class Reference

#include <ReactionRateCalculation.hh>

Inheritance diagram for ggl::chem::RRC_TState:

Public Member Functions
virtual double	getRate (const Reaction &reaction) const
virtual bool	needTransitionState (void) const
	RRC_TState ()
virtual	~RRC_TState ()
	default destruction More...

Detailed Description

A reaction rate calculator that does not calculate a rate (returns always "nan") but enforces, that the reactions transition state is calculated.

Author

Martin Mann (c) 2009 http://www.bioinf.uni-freiburg.de/~mmann/

Definition at line 111 of file ReactionRateCalculation.hh.

Constructor & Destructor Documentation

ggl::chem::RRC_TState::RRC_TState

(

)

Constructs a new reaction rate calculator that yields always the same reaction rate ("nan") but enforces the creation of the reactions transition state.

virtual ggl::chem::RRC_TState::~RRC_TState ( )

virtual

Member Function Documentation

virtual double ggl::chem::RRC_TState::getRate ( const Reaction &  reaction ) const

virtual

Returns a "nan" transition rate for all reactions.

Parameters

reaction

the Reaction object to calculate the rate for; but doesnt matter because "nan" returned!

Returns

"nan"

Implements ggl::chem::ReactionRateCalculation.

virtual bool ggl::chem::RRC_TState::needTransitionState ( void  ) const

virtual

YES, a transition state is needed!

Returns

true, because that's the class for! ;)

Implements ggl::chem::ReactionRateCalculation.

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

• src/ggl/chem/ReactionRateCalculation.hh