ProSHADE
0.6.5 (NOV 2018)
Protein Shape Descriptors and Symmetry Detection
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Files | |
file | ProSHADE.cpp [code] |
This file contains the constructors, destructors and other general functions intended to be used by the user. | |
file | ProSHADE.h [code] |
The main header file containing all declarations the user of the library needs. | |
file | ProSHADE_clipper.cpp [code] |
This file contains the function definitions for all functions interfacing clipper and processing the data from it. | |
file | ProSHADE_descriptors.cpp [code] |
This file contains all the functions for computing and pre-computing the three shape descriptors. | |
file | ProSHADE_files.cpp [code] |
This source file contains function and globals required for platform-independent file detection. | |
file | ProSHADE_files.h [code] |
This header file contains function and globals required for platform-independent file detection. | |
file | ProSHADE_internal.h [code] |
The main header file containing all declarations for the innter workings of the library. | |
file | ProSHADE_lapack.cpp [code] |
This file contains all the functions needed to access LAPACK library for linear algebra computations. | |
file | ProSHADE_legendre.h [code] |
This file contains all the functions related to computing the Gauss-Legendre integration variables. | |
file | ProSHADE_misc.h [code] |
This file contains the ProSHADE_internal_misc namespace and its miscellaneous functions. | |
file | ProSHADE_saveLoad.cpp [code] |
This file contains functions required for saving and reading from the database of structures. | |
file | ProSHADE_SO3transform.cpp [code] |
This file contains functions relating to the SO3 transform and symmetry detection in general. | |
file | ProSHADE_spharmonickit.cpp [code] |
This file contains all the functions related to computing the spherical harmonics decomposition. | |
file | ProSHADE_wigner.cpp [code] |
This file contains the functions required to compute Wigner D matrices for rotation in spherical harmonics space. | |