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IntegrateEllipsoids.h
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IntegrateEllipsoids.h
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#ifndef MANTID_MDALGORITHMS_INTEGRATE_ELLIPSOIDS_H_
#define MANTID_MDALGORITHMS_INTEGRATE_ELLIPSOIDS_H_
#include "MantidAPI/Algorithm.h"
#include "MantidAPI/MatrixWorkspace_fwd.h"
#include "MantidMDAlgorithms/MDWSDescription.h"
#include "MantidMDAlgorithms/Integrate3DEvents.h"
#include "MantidMDAlgorithms/UnitsConversionHelper.h"
#include "MantidMDAlgorithms/MDTransfInterface.h"
#include "MantidDataObjects/Workspace2D.h"
#include "MantidDataObjects/EventWorkspace.h"
#include "MantidDataObjects/PeaksWorkspace.h"
namespace Mantid {
namespace MDAlgorithms {
class DLLExport IntegrateEllipsoids : public API::Algorithm {
public:
const std::string name() const override;
/// Summary of algorithms purpose
const std::string summary() const override {
return "Integrate Single Crystal Diffraction Bragg peaks using 3D "
"ellipsoids.";
}
int version() const override;
const std::string category() const override;
private:
void init() override;
void exec() override;
void qListFromEventWS(Integrate3DEvents &integrator, API::Progress &prog,
DataObjects::EventWorkspace_sptr &wksp,
Kernel::DblMatrix const &UBinv, bool hkl_integ);
void qListFromHistoWS(Integrate3DEvents &integrator, API::Progress &prog,
DataObjects::Workspace2D_sptr &wksp,
Kernel::DblMatrix const &UBinv, bool hkl_integ);
/// Calculate if this Q is on a detector
void calculateE1(Geometry::Instrument_const_sptr inst);
void runMaskDetectors(Mantid::DataObjects::PeaksWorkspace_sptr peakWS,
std::string property, std::string values);
/// save for all detector pixels
std::vector<Kernel::V3D> E1Vec;
MDWSDescription m_targWSDescr;
void initTargetWSDescr(API::MatrixWorkspace_sptr &wksp);
};
} // namespace MDAlgorithms
} // namespace Mantid
#endif /* MANTID_MDALGORITHMS_INTEGRATE_ELLIPSOIDS_H_ */