This repository hosts the MolecularCagesGeneration project, which gathers algorithms and utilities for building and analyzing molecular cages.
- InterconnectionTreesEnumeration/ – contains the
Gen_ICTalgorithm and utilities used to analyze its behavior and performance. - PathsGeneration/ – implements the path generation workflow that connects binding patterns and includes demos plus benchmarking scripts.
Each folder includes its own README with more detailed, folder-specific guidance.