autofragment.algorithms

Modules

clustering	Clustering algorithms for molecular partitioning.
geometric	Geometric plane-based partitioning for molecular clusters.
graph_partition	Graph-based partitioning algorithms.
hungarian	Hungarian algorithm for optimal assignment.
ml_interface	Machine learning interface for fragmentation (Future).
optimizer	Fragmentation optimization algorithms.
scoring	Fragmentation scoring system.
seeding	Seeding strategies for k-means initialization.