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Bell-Evans model and steered molecular dynamics in uncovering the dissociation kinetics of ligands targeting G-protein-coupled receptors.
Sci Rep. 2022 Sep 24;12(1):15972. doi: 10.1038/s41598-022-20065-2.
Sci Rep. 2022.
PMID: 36153364
Free PMC article.
Probing Liquid-Ordered and Disordered Phases in Lipid Model Membranes: A Combined Theoretical and Spectroscopic Study of a Fluorescent Molecular Rotor.
Del Frate G, Macchiagodena M, Akhunzada MJ, D'Autilia F, Catte A, Bhattacharjee N, Barone V, Cardarelli F, Brancato G.
Del Frate G, et al. Among authors: akhunzada mj.
J Phys Chem B. 2022 Jan 20;126(2):480-491. doi: 10.1021/acs.jpcb.1c08324. Epub 2022 Jan 10.
J Phys Chem B. 2022.
PMID: 35001625
Free PMC article.
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Temperature Dependence of the Structure and Dynamics of a Dye-Labeled Lipid in a Planar Phospholipid Bilayer: A Computational Study.
Akhunzada MJ, Sagresti L, Catte A, Bhattacharjee N, D'Agostino T, Brancato G.
Akhunzada MJ, et al.
J Membr Biol. 2019 Oct;252(4-5):227-240. doi: 10.1007/s00232-019-00081-6. Epub 2019 Jul 22.
J Membr Biol. 2019.
PMID: 31332471
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