clustering
0.12
Clustering suite for molecular dynamics trajectories.
|
anonymous_namespace{network_builder.cpp} | |
Node | |
anonymous_namespace{state_filter.cpp} | |
Clustering | General namespace for clustering package |
Density | Namespace for density-based clustering functions |
MPI | MPI implementations of compute intensive functions |
anonymous_namespace{density_clustering_mpi.cpp} | |
OpenCL | OpenCL implementations of compute intensive functions |
BoxGrid | |
Filter | Functionality for filtering coordinates or order parameters (ASCII or GROMACS' .xtc) based on state trajectory |
MPP | Functions related to "Most Probable Path"-clustering |
NetworkBuilder | Functions for network creation from free energy screening |
Tools | Additional tools used throughout the clustering package |