rinse.h File Reference

#include <occ/core/linear_algebra.h>
#include <occ/crystal/crystal.h>
#include <optional>
#include <string>
#include <vector>

Include dependency graph for rinse.h:

Classes
struct	occ::descriptors::RinseParams
	Hyper-parameters for the RINSE descriptor. More...
struct	occ::descriptors::ReflectionList
	The reflections the descriptor is built from. More...
class	occ::descriptors::Rinse
	RINSE – Reciprocal-space INvariant Spectral Embedding. More...

Namespaces
namespace	occ
namespace	occ::descriptors

Enumerations
enum class	occ::descriptors::RinseRadialBasis { occ::descriptors::CVGaussian , occ::descriptors::LinGaussian }
	Radial basis for the RINSE descriptor. More...

Functions
ReflectionList	occ::descriptors::rinse_reflections (const crystal::Crystal &crystal, const RinseParams &params={})
	Enumerate the resolution sphere and compute reflection intensities.
Mat	occ::descriptors::rinse_radial_basis (Eigen::Ref< const Vec > q, const RinseParams &params)
	Evaluate the radial basis functions.
std::string	occ::descriptors::rinse_hash (Eigen::Ref< const Vec > descriptor, int num_words=default_hash_words)
	A locality-sensitive hash of a descriptor, as pronounceable proquints.
std::vector< bool >	occ::descriptors::rinse_hash_to_bits (std::string_view hash)
	Decode a proquint hash back to its bits, most significant first.

Variables
constexpr const char *	occ::descriptors::rinse_reference_version = "3.2.0"
	Number of proquint words produced by rinse_hash() unless asked otherwise.
constexpr int	occ::descriptors::default_hash_words = 1