Deganutti G[au] - Search Results

Year	Number of Results
2015	1
2016	2
2017	4
2018	6
2019	4
2020	9
2021	8
2022	8
2023	0

1

Peeking at G-protein-coupled receptors through the molecular dynamics keyhole.

Deganutti G, Moro S, Reynolds CA. Deganutti G, et al. Future Med Chem. 2019 Mar;11(6):599-615. doi: 10.4155/fmc-2018-0393. Epub 2019 Mar 19. Future Med Chem. 2019. PMID: 30888844 Free article. Review.

2

Is the Stalk of the SARS-CoV-2 Spike Protein Druggable?

Pipitò L, Reynolds CA, Deganutti G. Pipitò L, et al. Among authors: deganutti g. Viruses. 2022 Dec 14;14(12):2789. doi: 10.3390/v14122789. Viruses. 2022. PMID: 36560795 Free PMC article.

3

Molecular dynamics studies reveal structural and functional features of the SARS-CoV-2 spike protein.

Pipitò L, Rujan RM, Reynolds CA, Deganutti G. Pipitò L, et al. Among authors: deganutti g. Bioessays. 2022 Sep;44(9):e2200060. doi: 10.1002/bies.202200060. Epub 2022 Jul 17. Bioessays. 2022. PMID: 35843871 Free PMC article. Review.

4

Understanding VPAC receptor family peptide binding and selectivity.

Piper SJ, Deganutti G, Lu J, Zhao P, Liang YL, Lu Y, Fletcher MM, Hossain MA, Christopoulos A, Reynolds CA, Danev R, Sexton PM, Wootten D. Piper SJ, et al. Among authors: deganutti g. Nat Commun. 2022 Nov 16;13(1):7013. doi: 10.1038/s41467-022-34629-3. Nat Commun. 2022. PMID: 36385145 Free PMC article.

5

Dynamics of GLP-1R peptide agonist engagement are correlated with kinetics of G protein activation.

Deganutti G, Liang YL, Zhang X, Khoshouei M, Clydesdale L, Belousoff MJ, Venugopal H, Truong TT, Glukhova A, Keller AN, Gregory KJ, Leach K, Christopoulos A, Danev R, Reynolds CA, Zhao P, Sexton PM, Wootten D. Deganutti G, et al. Nat Commun. 2022 Jan 10;13(1):92. doi: 10.1038/s41467-021-27760-0. Nat Commun. 2022. PMID: 35013280 Free PMC article.

6

Estimation of kinetic and thermodynamic ligand-binding parameters using computational strategies.

Deganutti G, Moro S. Deganutti G, et al. Future Med Chem. 2017 Apr;9(5):507-523. doi: 10.4155/fmc-2016-0224. Epub 2017 Mar 31. Future Med Chem. 2017. PMID: 28362130 Review.

7

Exploring Ligand Binding to Calcitonin Gene-Related Peptide Receptors.

Deganutti G, Atanasio S, Rujan RM, Sexton PM, Wootten D, Reynolds CA. Deganutti G, et al. Front Mol Biosci. 2021 Aug 26;8:720561. doi: 10.3389/fmolb.2021.720561. eCollection 2021. Front Mol Biosci. 2021. PMID: 34513925 Free PMC article.

8

Peptidomimetic-based approach toward inhibitors of microbial trimethylamine lyases.

Gabr MT, Deganutti G, Reynolds CA. Gabr MT, et al. Among authors: deganutti g. Chem Biol Drug Des. 2021 Feb;97(2):231-236. doi: 10.1111/cbdd.13775. Epub 2020 Aug 19. Chem Biol Drug Des. 2021. PMID: 32772476

9

Structural and functional diversity among agonist-bound states of the GLP-1 receptor.

Cary BP, Deganutti G, Zhao P, Truong TT, Piper SJ, Liu X, Belousoff MJ, Danev R, Sexton PM, Wootten D, Gellman SH. Cary BP, et al. Among authors: deganutti g. Nat Chem Biol. 2022 Mar;18(3):256-263. doi: 10.1038/s41589-021-00945-w. Epub 2021 Dec 22. Nat Chem Biol. 2022. PMID: 34937906 Free PMC article.

10

Discovery and Structure-Activity Relationship Studies of Novel Adenosine A₁ Receptor-Selective Agonists.

Preti B, Suchankova A, Deganutti G, Leuenberger M, Barkan K, Manulak I, Huang X, Carvalho S, Ladds G, Lochner M. Preti B, et al. Among authors: deganutti g. J Med Chem. 2022 Nov 10;65(21):14864-14890. doi: 10.1021/acs.jmedchem.2c01414. Epub 2022 Oct 21. J Med Chem. 2022. PMID: 36270633 Free PMC article.

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