Discovering privileged topologies of molecular knots with self-assembling models

Only a few different types of supramolecular knots have been synthesized so far. Here the authors use Monte Carlo sampling, molecular dynamics and combinatorics to discover new knot types made of identical templates.

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Detalles Bibliográficos
Autores principales: Mattia Marenda, Enzo Orlandini, Cristian Micheletti
Formato: article
Lenguaje:EN
Publicado: Nature Portfolio 2018
Materias:
Q
Acceso en línea:https://doaj.org/article/b295faf6c2fb443184819a942d006c3f
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Descripción
Sumario:Only a few different types of supramolecular knots have been synthesized so far. Here the authors use Monte Carlo sampling, molecular dynamics and combinatorics to discover new knot types made of identical templates.