240 lines
7.4 KiB
C++
240 lines
7.4 KiB
C++
//
|
||
// ********************************************************************
|
||
// * License and Disclaimer *
|
||
// * *
|
||
// * The Geant4 software is copyright of the Copyright Holders of *
|
||
// * the Geant4 Collaboration. It is provided under the terms and *
|
||
// * conditions of the Geant4 Software License, included in the file *
|
||
// * LICENSE and available at http://cern.ch/geant4/license . These *
|
||
// * include a list of copyright holders. *
|
||
// * *
|
||
// * Neither the authors of this software system, nor their employing *
|
||
// * institutes,nor the agencies providing financial support for this *
|
||
// * work make any representation or warranty, express or implied, *
|
||
// * regarding this software system or assume any liability for its *
|
||
// * use. Please see the license in the file LICENSE and URL above *
|
||
// * for the full disclaimer and the limitation of liability. *
|
||
// * *
|
||
// * This code implementation is the result of the scientific and *
|
||
// * technical work of the GEANT4 collaboration. *
|
||
// * By using, copying, modifying or distributing the software (or *
|
||
// * any work based on the software) you agree to acknowledge its *
|
||
// * use in resulting scientific publications, and indicate your *
|
||
// * acceptance of all terms of the Geant4 Software license. *
|
||
// ********************************************************************
|
||
//
|
||
// Author: Mathieu Karamitros
|
||
|
||
// The code is developed in the framework of the ESA AO7146
|
||
//
|
||
// We would be very happy hearing from you, send us your feedback! :)
|
||
//
|
||
// In order for Geant4-DNA to be maintained and still open-source,
|
||
// article citations are crucial.
|
||
// If you use Geant4-DNA chemistry and you publish papers about your software,
|
||
// in addition to the general paper on Geant4-DNA:
|
||
//
|
||
// Int. J. Model. Simul. Sci. Comput. 1 (2010) 157–178
|
||
//
|
||
// we would be very happy if you could please also cite the following
|
||
// reference papers on chemistry:
|
||
//
|
||
// J. Comput. Phys. 274 (2014) 841-882
|
||
// Prog. Nucl. Sci. Tec. 2 (2011) 503-508
|
||
|
||
#ifndef G4MoleculeCounter_h
|
||
#define G4MoleculeCounter_h
|
||
|
||
#include "G4VMoleculeCounter.hh"
|
||
#include <map>
|
||
#include <memory>
|
||
#include <set>
|
||
#include <vector>
|
||
|
||
//------------------------------------------------------------------------------
|
||
|
||
struct compDoubleWithPrecision{
|
||
bool operator()(const double& a, const double& b) const{
|
||
if (std::fabs(a - b) < fPrecision){
|
||
return false;
|
||
}
|
||
else{
|
||
return a < b;
|
||
}
|
||
}
|
||
|
||
static G4ThreadLocal double fPrecision;
|
||
};
|
||
|
||
//------------------------------------------------------------------------------
|
||
|
||
typedef std::map<G4double, G4int, compDoubleWithPrecision>
|
||
NbMoleculeAgainstTime;
|
||
|
||
typedef std::unique_ptr<std::set<G4double> > RecordedTimes;
|
||
typedef std::set<G4double>::iterator RecordedTimesIterator;
|
||
|
||
//------------------------------------------------------------------------------
|
||
|
||
class G4MoleculeCounter : public G4VMoleculeCounter
|
||
{
|
||
//----------------------------------------------------------------------------
|
||
public:
|
||
typedef std::map<G4MolecularConfiguration*,
|
||
NbMoleculeAgainstTime> CounterMapType;
|
||
typedef std::unique_ptr<std::vector<G4MolecularConfiguration*> >
|
||
RecordedMolecules;
|
||
|
||
//----------------------------------------------------------------------------
|
||
protected:
|
||
G4MoleculeCounter();
|
||
virtual ~G4MoleculeCounter();
|
||
|
||
CounterMapType fCounterMap;
|
||
std::map<const G4MoleculeDefinition*, G4bool> fDontRegister;
|
||
|
||
G4int fVerbose;
|
||
G4bool fCheckTimeIsConsistentWithScheduler;
|
||
|
||
struct Search
|
||
{
|
||
Search(){
|
||
fLowerBoundSet = false;
|
||
}
|
||
CounterMapType::iterator fLastMoleculeSearched;
|
||
NbMoleculeAgainstTime::iterator fLowerBoundTime;
|
||
bool fLowerBoundSet;
|
||
};
|
||
|
||
std::unique_ptr<Search> fpLastSearch;
|
||
|
||
#ifdef MOLECULE_COUNTER_TESTING
|
||
public:
|
||
#else
|
||
protected:
|
||
#endif
|
||
|
||
friend class G4Molecule;
|
||
friend class G4VMoleculeCounter;
|
||
|
||
//----------------------------------------------------------------------------
|
||
public:
|
||
static G4MoleculeCounter* Instance();
|
||
|
||
//----------------------------------------------------------------------------
|
||
public:
|
||
void Initialize() override;
|
||
|
||
void ResetCounter() override;
|
||
|
||
void AddAMoleculeAtTime(G4MolecularConfiguration*,
|
||
G4double time,
|
||
const G4ThreeVector* position = nullptr,
|
||
int number = 1) override;
|
||
void RemoveAMoleculeAtTime(G4MolecularConfiguration*,
|
||
G4double time,
|
||
const G4ThreeVector* position = nullptr,
|
||
int number = 1) override;
|
||
|
||
/* The dynamics of the given molecule won't be saved into memory.*/
|
||
inline void DontRegister(const G4MoleculeDefinition*) override;
|
||
inline bool IsRegistered(const G4MoleculeDefinition*) override;
|
||
inline void RegisterAll() override;
|
||
|
||
//----------------------------------------------------------------------------
|
||
public:
|
||
int GetNMoleculesAtTime(G4MolecularConfiguration* molecule,
|
||
double time);
|
||
inline const NbMoleculeAgainstTime&
|
||
GetNbMoleculeAgainstTime(G4MolecularConfiguration* molecule);
|
||
|
||
RecordedMolecules GetRecordedMolecules();
|
||
RecordedTimes GetRecordedTimes();
|
||
|
||
inline void SetVerbose(G4int);
|
||
inline G4int GetVerbose();
|
||
|
||
/*
|
||
* It sets the min time difference in between two time slices.
|
||
*/
|
||
void SetTimeSlice(double);
|
||
|
||
|
||
void Dump();
|
||
|
||
inline G4bool IsTimeCheckedForConsistency() const
|
||
{
|
||
return fCheckTimeIsConsistentWithScheduler;
|
||
}
|
||
|
||
inline void CheckTimeForConsistency(G4bool flag)
|
||
{
|
||
fCheckTimeIsConsistentWithScheduler = flag;
|
||
}
|
||
|
||
//----------------------------------------------------------------------------
|
||
protected:
|
||
G4bool SearchTimeMap(G4MolecularConfiguration* molecule);
|
||
int SearchUpperBoundTime(double time, bool sameTypeOfMolecule);
|
||
};
|
||
|
||
//------------------------------------------------------------------------------
|
||
|
||
inline void G4MoleculeCounter::ResetCounter()
|
||
{
|
||
if(fVerbose)
|
||
{
|
||
G4cout << " ---> G4MoleculeCounter::ResetCounter" << G4endl;
|
||
}
|
||
fCounterMap.clear();
|
||
fpLastSearch.reset(0);
|
||
}
|
||
|
||
//------------------------------------------------------------------------------
|
||
|
||
inline const NbMoleculeAgainstTime&
|
||
G4MoleculeCounter::GetNbMoleculeAgainstTime(G4MolecularConfiguration* molecule)
|
||
{
|
||
return fCounterMap[molecule];
|
||
}
|
||
|
||
//------------------------------------------------------------------------------
|
||
|
||
inline void G4MoleculeCounter::SetVerbose(G4int level)
|
||
{
|
||
fVerbose = level;
|
||
}
|
||
|
||
//------------------------------------------------------------------------------
|
||
|
||
inline G4int G4MoleculeCounter::GetVerbose()
|
||
{
|
||
return fVerbose;
|
||
}
|
||
|
||
//------------------------------------------------------------------------------
|
||
|
||
inline void
|
||
G4MoleculeCounter::DontRegister(const G4MoleculeDefinition* molDef)
|
||
{
|
||
fDontRegister[molDef] = true;
|
||
}
|
||
|
||
//------------------------------------------------------------------------------
|
||
|
||
inline bool
|
||
G4MoleculeCounter::IsRegistered(const G4MoleculeDefinition* molDef)
|
||
{
|
||
if(fDontRegister.find(molDef) == fDontRegister.end()) return true;
|
||
return false;
|
||
}
|
||
|
||
//------------------------------------------------------------------------------
|
||
|
||
inline void G4MoleculeCounter::RegisterAll()
|
||
{
|
||
fDontRegister.clear();
|
||
}
|
||
|
||
#endif
|