// // ******************************************************************** // * 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. * // ******************************************************************** // /// \file MoleculeCounter.hh /// \brief Definition of the MoleculeCounter class // The `molcounters` example(s) are provided as part of Geant4-DNA // and any report or published result obtained using it shall cite // the respective Geant4-DNA collaboration publications. // // Reports or results obtained using the spatially-aware `MoleculeCounter` // provided in this example, shall further cite: // // Velten & Tomé, Radiation Physics and Chemistry, 2023 (10.1016/j.radphyschem.2023.111194) // // // Author: Christian Velten (2025) // #ifndef MoleculeCounter_hh #define MoleculeCounter_hh 1 #include "G4MolecularConfiguration.hh" #include "G4VPhysicalVolume.hh" #include "G4VTouchable.hh" #include "G4VUserMoleculeCounter.hh" #include #include #include class G4Navigator; class G4StepPoint; class G4Material; class G4Track; //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo...... struct MoleculeCounterIndex : G4VMoleculeCounter::G4VMoleculeCounterIndex { const G4MolecularConfiguration* Molecule; const G4VPhysicalVolume* Volume; std::vector CopyNumbers; MoleculeCounterIndex() : Molecule(nullptr), Volume(nullptr), CopyNumbers() {} MoleculeCounterIndex(const MoleculeCounterIndex&) = default; MoleculeCounterIndex(MoleculeCounterIndex&&) = default; MoleculeCounterIndex(const G4MolecularConfiguration* molecule, const G4VTouchable* touchable) : Molecule(molecule), CopyNumbers() { if (touchable == nullptr) { Volume = nullptr; } else { Volume = touchable->GetVolume(); CopyNumbers.reserve(touchable->GetHistoryDepth()); for (auto i = 0; i < touchable->GetHistoryDepth(); ++i) CopyNumbers.push_back(touchable->GetCopyNumber(i)); } } MoleculeCounterIndex(const G4MolecularConfiguration* molecule, const G4VPhysicalVolume* volume, // should be removed ? const std::vector& copyNumbers) : Molecule(molecule), Volume(volume), CopyNumbers(copyNumbers) {} ~MoleculeCounterIndex() override = default; MoleculeCounterIndex& operator=(const MoleculeCounterIndex&) = default; MoleculeCounterIndex& operator=(MoleculeCounterIndex&&) = default; G4bool operator<(G4VMoleculeCounterIndex const& other) const override { return *this < dynamic_cast(other); } G4bool operator<(MoleculeCounterIndex const& other) const { if (std::less<>{}(Molecule, other.Molecule)) return true; if (std::less<>{}(other.Molecule, Molecule)) return false; if (std::less<>{}(Volume, other.Volume)) return true; if (std::less<>{}(other.Volume, Volume)) return false; return CopyNumbers < other.CopyNumbers; } G4bool operator==(G4VMoleculeCounterIndex const& other) const override { return *this == dynamic_cast(other); } G4bool operator==(const MoleculeCounterIndex& other) const { return std::tie(Molecule, Volume) == std::tie(other.Molecule, other.Volume) && CopyNumbers == other.CopyNumbers; } G4String GetInfo() const override { G4String info = "("; const G4String& null = "null"; info += Molecule == nullptr ? null : Molecule->GetName(); info += ", "; info += Volume == nullptr ? null : Volume->GetName(); info += ")"; return info; } const G4MolecularConfiguration* GetMolecule() const override { return Molecule; } }; //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo...... class MoleculeCounter : public G4VUserMoleculeCounter { public: MoleculeCounter(G4String = "MoleculeCounter"); ~MoleculeCounter() override = default; public: void InitializeUser() override; std::unique_ptr BuildIndex(const G4Track*) const override; std::unique_ptr BuildIndex(const G4Track*, const G4StepPoint*) const override; std::unique_ptr BuildSimpleIndex(const G4MolecularConfiguration*) const override; G4bool GetIgnoreMoleculePosition() const; void SetIgnoreMoleculePosition(G4bool); void SetNegativeCountsAreFatal(G4bool); protected: static G4ThreadLocal std::unique_ptr fNavigator; G4bool fIgnoreMoleculePosition{false}; G4bool fIgnoreCopyNumbers{false}; }; //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo...... #endif