A Python package for building metal-organic cages from nodes and linkers, identifying and functionalising available linker sites, and enumerating symmetry-unique cage and MOF isomers.
supramolecular-chemistrymofstructuremetal-organic-cagecage-isomer-enumerationmof-isomerismcage-topologyisomer-enumeration
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Updated
Jul 23, 2026 - Python