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Rosetta
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#include <core/energy_methods/FiberDiffractionEnergyDens.hh>#include <core/scoring/fiber_diffraction/FiberDiffraction.hh>#include <core/scoring/fiber_diffraction/util.hh>#include <core/scoring/fiber_diffraction/util_ndft.hh>#include <core/scoring/fiber_diffraction/hankel_kiss_fft.hh>#include <core/scoring/fiber_diffraction/xray_scattering.hh>#include <core/scoring/electron_density/ElectronDensity.hh>#include <core/pose/Pose.hh>#include <core/chemical/AtomType.hh>#include <core/chemical/AtomTypeSet.hh>#include <core/conformation/Residue.hh>#include <core/id/AtomID.hh>#include <core/conformation/symmetry/SymmetricConformation.hh>#include <core/conformation/symmetry/SymmetryInfo.hh>#include <core/pose/symmetry/util.hh>#include <basic/options/option.hh>#include <basic/options/keys/score.OptionKeys.gen.hh>#include <basic/options/keys/edensity.OptionKeys.gen.hh>#include <basic/Tracer.hh>#include <string>#include <core/energy_methods/FiberDiffractionEnergyDensCreator.hh>#include <core/scoring/EnergyMap.hh>#include <numeric/interpolation/spline/SplineGenerator.hh>#include <ObjexxFCL/FArray1D.hh>#include <fstream>Namespaces | |
| core | |
| A class for reading in the atom type properties. | |
| core::energy_methods | |
Functions | |
| static basic::Tracer | core::energy_methods::TR ("core.energy_methods.FiberDiffractionEnergyDens") |
| void | core::energy_methods::gnl_R_qfht (ObjexxFCL::FArray3D< float > &fourier_in, utility::vector0< utility::vector0< int > >::iterator &nvals, core::Size &lmax, core::Real &max_r_value, double &qfht_K1, double &qfht_K2, ObjexxFCL::FArray3D< std::complex< float > > &Gnl) |
| utility::pointer::shared_ptr< numeric::interpolation::spline::Interpolator > | core::energy_methods::fit_layer_lines_with_splines (ObjexxFCL::FArray1D< float > xvals, ObjexxFCL::FArray1D< float > yvals) |