Halogen bond interaction: Role of hybridization and induction

Autor: Nunzi, Francesca, Cesario, Diego, Tarantelli, Francesco, Belpassi, Leonardo

Publikováno v: In Chemical Physics Letters 16 May 2021 771

Modeling the Interaction of SARS-CoV-2 Membrane Phospholipids with Photocatalitically Active Titanium Dioxide

Autor: Iván, Soriano-Díaz, Eros, Radicchi, Bizzarri, Beatrice, Olivia, Bizzarri, Mosconi, Edoardo, Muhammad Waqar Ashraf, DE ANGELIS, Filippo, Nunzi, Francesca

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=od______3982::1e274335acd2eedf1d3eafe50305eb2b
https://hdl.handle.net/11391/1554518

Tento výsledek nelze pro nepřihlášené uživatele zobrazit.
K zobrazení výsledku je třeba se přihlásit.

The role of the halogen bond in iodothyronine deiodinase

Autor: Cesario, Diego, Fortino, Mariagrazia, Marino, Tiziana, Nunzi, Francesca, Russo, Nino, Sicilia, Emilia

Publikováno v: Cesario, D, Fortino, M, Marino, T, Nunzi, F, Russo, N & Sicilia, E 2019, ' The role of the halogen bond in iodothyronine deiodinase : Dependence on chalcogen substitution in naphthyl-based mimetics ', Journal of Computational Chemistry, vol. 40, no. 8, pp. 944-951 . https://doi.org/10.1002/jcc.25775
Journal of Computational Chemistry, 40(8), 944-951. John Wiley and Sons Inc.

The effects on the activity of thyroxine (T4) due to the chalcogen replacement in a series of peri-substituted naphthalenes mimicking the catalytic function of deiodinase enzymes are computationally examined using density functional theory. In partic

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=dedup_wf_001::30a09b7b5543a1a6293610f0be84fc4e
http://www.scopus.com/inward/record.url?scp=85060546582&partnerID=8YFLogxK

Tento výsledek nelze pro nepřihlášené uživatele zobrazit.
K zobrazení výsledku je třeba se přihlásit.