stage/include/ost/mol/alg/structure_analysis.hh File Reference

#include <ost/mol/alg/module_config.hh>
#include <ost/mol/entity_view.hh>
#include <ost/mol/entity_handle.hh>
#include <ost/img/map.hh>

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Namespaces

namespace  ost
namespace  ost::mol
namespace  ost::mol::alg

Functions

geom::Vec3List DLLIMPORT GetPosListFromView (const EntityView &view)
std::vector< Real > DLLIMPORT CalculateAgreementWithDensityMap (const geom::Vec3List &vl, img::MapHandle &density_map)
Real DLLIMPORT CalculateAverageAgreementWithDensityMap (const geom::Vec3List &vl, img::MapHandle &density_map)
void DLLIMPORT WrapEntityInPeriodicCell (EntityHandle eh, const geom::Vec3 cell_center, const geom::Vec3 ucell_size, const geom::Vec3 ucell_angles=geom::Vec3(), bool group_res=true, bool follow_bond=true)
std::vector< std::vector< Real >
> DLLIMPORT 
PariwiseDistanceMatrix (const EntityView &view1, const EntityView &view2)
std::vector< std::vector< Real >
> DLLIMPORT 
PariwiseDistanceMatrix (const EntityView &view)
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