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The Mechanism of Flex‐Activation in Mechanophores Revealed By Quantum Chemistry

Flex‐activated mechanophores can be used for small‐molecule release in polymers under tension by rupture of covalent bonds that are orthogonal to the polymer main chain. Using static and dynamic quantum chemical methods, we here juxtapose three different mechanical deformation modes in flex‐activate...

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Detalles Bibliográficos
Autores principales: Mier, Lennart J., Adam, Gheorghe, Kumar, Sourabh, Stauch, Tim
Formato: Online Artículo Texto
Lenguaje:English
Publicado: John Wiley and Sons Inc. 2020
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7702058/
https://www.ncbi.nlm.nih.gov/pubmed/32964598
http://dx.doi.org/10.1002/cphc.202000739