autofragment.core

Core data structures and utilities for autofragment.

Modules

atom	Memory-efficient atom storage utilities.
bonds	Bond detection and interfragment bond representation.
chemistry	Chemistry utilities and periodic table data.
geometry	Geometric utilities for isolated molecular fragments.
graph	Graph-based molecular representation using networkx.
lattice	Lattice vector representation and operations.
periodic	Periodic boundary condition utilities.
types	Core data types for autofragment.