| Literature DB >> 33467467 |
Anton I Kudelin1, Konstantinos Papathanasiou2, Vera Isaeva1,2, Juergen Caro3, Tapio Salmi4, Leonid M Kustov1,2,5.
Abstract
The coordination polymer CPO-27-Mg was rapidly synthesized under microwave irradiation. This material exhibits a sufficiently high drug loading towards aspirin (~8% wt.) and paracetamol (~14% wt.). The binding of these two molecules with the inner surface of the metal-organic framework was studied employing the Gaussian and Plane Wave approach of the Density Functional Theory. The structure of CPO-27-Mg persists after the adsorption of aspirin or paracetamol and their desorption energies, being quite high, decrease under solvent conditions.Entities:
Keywords: CPO-27; aspirin; drug delivery; metal-organic frameworks; microwave synthesis; paracetamol
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Year: 2021 PMID： 33467467 PMCID： PMC7830474 DOI： 10.3390/molecules26020426
Source DB: PubMed Journal: Molecules ISSN： 1420-3049 Impact factor: 4.411