Structural Bioinformatics Library
Template C++ / Python API for developping structural bioinformatics applications.
Conformational_ensemble_analysis

Classes

class  T_Conformational_ensemble_analysis_traits< GeometricKernel, DistanceFunction, TDensityFunction >
 Traits class for instantiating the workflow T_Conformational_ensemble_analysis_workflow. debug. More...
 
class  T_Conformational_ensemble_analysis_workflow< Traits >
 Generic workflow of Conformational_ensemble_analysis for reading the command line options of the applications and running the calculations.
More...
 
class  T_Morse_function_for_elevated_NNG< Graph, NT, IsReversedMorseFunction >
 Density function where values are already computed and stored in the NNG. More...
 
class  T_Morse_function_for_NNG_density_from_neighbors< Graph >
 Density function proportional to the number of neighbors of a vertex in the NNG. More...
 
class  T_Morse_function_for_NNG_density_from_distance_to_neighbors< Graph >
 Density function proportional to the mean distance between a given vertex and all his neighbors. More...
 
class  T_Morse_function_for_NNG_density_from_inverse_distance_to_neighbors< Graph >
 Density function inversely proportional to the distance sum between a given vertex and all his neighbors. More...
 
class  T_Morse_function_for_NNG_density_from_gaussian< Graph >
 Density function proportional to a normal Gaussian estimation over the distances between a given vertex and all his neighbors. More...
 
class  T_Conformational_ensemble_MST_module< ModuleTraits >
 Module for computing the MST of an input NNG. More...
 
class  T_Conformational_ensemble_pairwise_distances_module< ModuleTraits >
 Module for computing all the pairwise distances of an input conformational ensemble. More...
 
class  T_Conformational_ensemble_sampling_diversity_analysis_module< ModuleTraits >
 Module for analyzing the diversity of a conformational ensemble. More...
 

Description