ProSHADE_internal.h File Reference

The main header file containing all declarations for the innter workings of the library. More...

#include "ProSHADE_version.h"
#include "ProSHADE_rvapi.h"

Go to the source code of this file.

Classes
class	ProSHADE_internal::ProSHADE_symmetry
	This is the class which computes the symmetry in a single structure. More...
class	ProSHADE_internal::ProSHADE_data
	This class deals with reading in the data and computing structure specific information including the spherical harmonics coefficients. More...
class	ProSHADE_internal::ProSHADE_comparePairwise
	This is the executive class responsible for comparing strictly two structures. More...
class	ProSHADE_internal::ProSHADE_compareOneAgainstAll
	This is the executive class responsible for comparing two or more structures. More...
class	ProSHADE_internal::ProSHADE_distances
	This is the executive class for computing distances between two or more structures. More...
class	ProSHADE_internal::ProSHADE_mapFeatures
	This class is responsible for reading in map and computing all its features and other possible map manipulation. More...

Namespaces
	ProSHADE_internal
	This namespace contains all the internal objects and their forward declarations.

Functions
unsigned int	ProSHADE_internal::checkFileType (std::string fileName)
	This function checks the input file for being either PDB or MAP formatted. More...

Detailed Description

This is the header file containig declarations of all classes and functions required by the library.

This file is part of the ProSHADE library for calculating shape descriptors and symmetry operators of protein structures. This is a prototype code, which is by no means complete or fully tested. Its use is at your own risk only. There is no quarantee that the results are correct.

Author

Michal Tykac

Garib N. Murshudov

Version

0.6.5

Date

NOV 2018

Definition in file ProSHADE_internal.h.