An evolutionary algorithm for the discovery of porous organic cages

E Berardo, L Turcani, M Miklitz, KE Jelfs - Chemical Science, 2018 - pubs.rsc.org
The chemical and structural space of possible molecular materials is enormous, as they can,
in principle, be built from any combination of organic building blocks. Here we have …

Characterization of molecular belts' shape in the context of porous molecular materials

I Gomez, M Haranczyk, M Chaves-Salado, IG García - 2021 - chemrxiv.org
Porous molecular belts are a common type of porous molecules that can be assembled into
nanotube porous crystals for various applications. The inherited nature of crystal porosity …