G4DNAMolecularReactionData Class Reference

#include <G4DNAMolecularReactionTable.hh>

Public Member Functions
	G4DNAMolecularReactionData (G4double reactionRate, const G4Molecule *reactive1, const G4Molecule *reactive2)
	~G4DNAMolecularReactionData ()
const G4Molecule *	GetReactive1 () const
const G4Molecule *	GetReactive2 () const
G4double	GetReactionRate () const
G4double	GetReducedReactionRadius () const
void	SetReactive1 (const G4Molecule *reactive)
void	SetReactive2 (const G4Molecule *reactive)
void	SetReactive (const G4Molecule *reactive1, const G4Molecule *reactive2)
void	AddProduct (const G4Molecule *molecule)
G4int	GetNbProducts () const
const G4Molecule *	GetProduct (G4int i) const

Protected Member Functions
	G4DNAMolecularReactionData ()

Protected Attributes
G4MoleculeHandle	fReactive1
G4MoleculeHandle	fReactive2
G4double	fReactionRate
G4double	fReducedReactionRadius
std::vector< G4MoleculeHandle > *	fProducts

Detailed Description

G4DNAMolecularReactionData contains the information relative to a given reaction (eg : °OH + °OH -> H2O2)

Definition at line 56 of file G4DNAMolecularReactionTable.hh.

Constructor & Destructor Documentation

G4DNAMolecularReactionData() [1/2]

G4DNAMolecularReactionData::G4DNAMolecularReactionData	(	G4double	reactionRate,
		const G4Molecule *	reactive1,
		const G4Molecule *	reactive2
	)

Definition at line 58 of file G4DNAMolecularReactionTable.cc.

                                                    :fProducts(0)
{
    fReactionRate = reactionRate;
    SetReactive1(reactive1);
    SetReactive2(reactive2);
 
    G4double sumDiffCoeff(0.);
 
    if(*reactive1 == *reactive2)
    {
        sumDiffCoeff = reactive1->GetDiffusionCoefficient();
        fReducedReactionRadius = fReactionRate/(4*pi* reactive1->GetDiffusionCoefficient() * Avogadro);
    }
    else
    {
        sumDiffCoeff = reactive1->GetDiffusionCoefficient() + reactive2->GetDiffusionCoefficient();
        fReducedReactionRadius = fReactionRate/(4*pi* sumDiffCoeff  * Avogadro);
    }
}

~G4DNAMolecularReactionData()

G4DNAMolecularReactionData::~G4DNAMolecularReactionData

(

)

Definition at line 80 of file G4DNAMolecularReactionTable.cc.

{
    if(fProducts)
    {
        fProducts->clear() ;
        delete fProducts;
        fProducts = 0;
    }
}

G4DNAMolecularReactionData() [2/2]

G4DNAMolecularReactionData::G4DNAMolecularReactionData ( )

protected

Definition at line 52 of file G4DNAMolecularReactionTable.cc.

                                                      :
    fReactive1(),fReactive2(),
    fReactionRate(0.),fReducedReactionRadius(0.),
    fProducts(0)
{;}

Member Function Documentation

AddProduct()

void G4DNAMolecularReactionData::AddProduct

(

const G4Molecule *

molecule

)

Definition at line 105 of file G4DNAMolecularReactionTable.cc.

{
    if(!fProducts) fProducts = new std::vector<G4MoleculeHandle>();
    fProducts->push_back(G4MoleculeHandleManager::Instance()->GetMoleculeHandle(molecule));
}

Referenced by G4EmDNAPhysicsChemistry::ConstructReactionTable().

GetNbProducts()

G4int G4DNAMolecularReactionData::GetNbProducts ( ) const

inline

Definition at line 76 of file G4DNAMolecularReactionTable.hh.

    {
        if(fProducts) return fProducts->size();
        return 0;
    }

Referenced by G4DNAMolecularReaction::MakeReaction(), and G4DNAMolecularReactionTable::PrintTable().

GetProduct()

const G4Molecule * G4DNAMolecularReactionData::GetProduct ( G4int  i ) const

inline

Definition at line 82 of file G4DNAMolecularReactionTable.hh.

    {
        if(fProducts) return (*fProducts)[i].get();
        return 0;
    }

Referenced by G4DNAMolecularReaction::MakeReaction(), and G4DNAMolecularReactionTable::PrintTable().

GetReactionRate()

G4double G4DNAMolecularReactionData::GetReactionRate ( ) const

inline

Definition at line 67 of file G4DNAMolecularReactionTable.hh.

{return fReactionRate;}

Referenced by G4DNAMolecularReactionTable::PrintTable().

GetReactive1()

const G4Molecule * G4DNAMolecularReactionData::GetReactive1 ( ) const

inline

Definition at line 64 of file G4DNAMolecularReactionTable.hh.

{ return fReactive1.get(); }

Referenced by G4DNAMolecularReactionTable::SetReaction(), and G4DNAMolecularReactionTable::~G4DNAMolecularReactionTable().

GetReactive2()

const G4Molecule * G4DNAMolecularReactionData::GetReactive2 ( ) const

inline

Definition at line 65 of file G4DNAMolecularReactionTable.hh.

{ return fReactive2.get(); }

Referenced by G4DNAMolecularReactionTable::SetReaction(), and G4DNAMolecularReactionTable::~G4DNAMolecularReactionTable().

GetReducedReactionRadius()

G4double G4DNAMolecularReactionData::GetReducedReactionRadius ( ) const

inline

Definition at line 68 of file G4DNAMolecularReactionTable.hh.

{return fReducedReactionRadius;}

SetReactive()

void G4DNAMolecularReactionData::SetReactive	(	const G4Molecule *	reactive1,
		const G4Molecule *	reactive2
	)

Definition at line 98 of file G4DNAMolecularReactionTable.cc.

{
    fReactive1 = G4MoleculeHandleManager::Instance()->GetMoleculeHandle(reactive1);
    fReactive2 = G4MoleculeHandleManager::Instance()->GetMoleculeHandle(reactive2);
}

SetReactive1()

void G4DNAMolecularReactionData::SetReactive1

(

const G4Molecule *

reactive

)

Definition at line 90 of file G4DNAMolecularReactionTable.cc.

{
    fReactive1 = G4MoleculeHandleManager::Instance()->GetMoleculeHandle(reactive);
}

Referenced by G4DNAMolecularReactionData().

SetReactive2()

void G4DNAMolecularReactionData::SetReactive2

(

const G4Molecule *

reactive

)

Definition at line 94 of file G4DNAMolecularReactionTable.cc.

{
    fReactive2 = G4MoleculeHandleManager::Instance()->GetMoleculeHandle(reactive);
}

Referenced by G4DNAMolecularReactionData().

Member Data Documentation

fProducts

std::vector<G4MoleculeHandle>* G4DNAMolecularReactionData::fProducts

protected

Definition at line 95 of file G4DNAMolecularReactionTable.hh.

Referenced by AddProduct(), GetNbProducts(), GetProduct(), and ~G4DNAMolecularReactionData().

fReactionRate

G4double G4DNAMolecularReactionData::fReactionRate

protected

Definition at line 92 of file G4DNAMolecularReactionTable.hh.

Referenced by G4DNAMolecularReactionData(), and GetReactionRate().

fReactive1

G4MoleculeHandle G4DNAMolecularReactionData::fReactive1

protected

Definition at line 90 of file G4DNAMolecularReactionTable.hh.

Referenced by GetReactive1(), SetReactive(), and SetReactive1().

fReactive2

G4MoleculeHandle G4DNAMolecularReactionData::fReactive2

protected

Definition at line 91 of file G4DNAMolecularReactionTable.hh.

Referenced by GetReactive2(), SetReactive(), and SetReactive2().

fReducedReactionRadius

G4double G4DNAMolecularReactionData::fReducedReactionRadius

protected

Definition at line 93 of file G4DNAMolecularReactionTable.hh.

Referenced by G4DNAMolecularReactionData(), and GetReducedReactionRadius().

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

• G4DNAMolecularReactionTable.hh
• G4DNAMolecularReactionTable.cc