The Journal of chemical physics
Structural and compositional complexities of hierarchical self-assembly: A hypergraph approach.
Alexei V Tkachenko
Published: 202610.1063/5.0300698
Abstract
Programmable self-assembly enables the construction of complex molecular, supramolecular, and crystalline architectures from well-designed building blocks. We introduce a hypergraph-based formalism, Blocks & Bonds (B&B), which generalizes classical c…
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