/** * \file IMP/em/envelope_penetration.h * \brief functions for calculation envelope penetration * * Copyright 2007-2013 IMP Inventors. All rights reserved. * */ #ifndef IMPEM_ENVELOPE_PENETRATION_H #define IMPEM_ENVELOPE_PENETRATION_H #include #include "DensityMap.h" #include IMPEM_BEGIN_NAMESPACE //! Get the number of particles that are outside of the density /** /note the function assumes that all of the particles have XYZ coordinates */ IMPEMEXPORT long get_number_of_particles_outside_of_the_density( DensityMap *dmap,const Particles &ps, const IMP::algebra::Transformation3D &t= IMP::algebra::get_identity_transformation_3d(),float thr=0.0); //! Get numbers of particles (mult transforms) that are outside the density /** /note the function assumes that all of the particles have XYZ coordinates */ IMPEMEXPORT Ints get_numbers_of_particles_outside_of_the_density( DensityMap *dmap,const Particles &ps, const IMP::algebra::Transformation3Ds &transformations,float thr=0.0); //! Get the number of density voxels that are not covered by particles /** /note the function assumes that all of the particles have XYZ coordinates */ IMPEMEXPORT double get_percentage_of_voxels_covered_by_particles( DensityMap *dmap,const Particles &ps, float smoothing_radius=3., const IMP::algebra::Transformation3D &t= IMP::algebra::get_identity_transformation_3d(),float thr=0.0); IMPEM_END_NAMESPACE #endif /* IMPEM_ENVELOPE_PENETRATION_H */