Temperature dependence of the structure and dynamics of a dye-labeled lipid in a planar phospholipid bilayer: A computational study MJ Akhunzada, L Sagresti, A Catte, N Bhattacharjee, T D’Agostino, ... The Journal of membrane biology 252 (4), 227-240, 2019 | 7 | 2019 |
Expanding the Chemical Space of Tetracyanobuta‐1, 3‐diene (TCBD) through a Cyano‐Diels‐Alder Reaction: Synthesis, Structure, and Physicochemical Properties of an Anthryl‐fused … LM Mateo, L Sagresti, Y Luo, DM Guldi, T Torres, G Brancato, G Bottari Chemistry–A European Journal 27 (64), 16049-16055, 2021 | 6 | 2021 |
One-step functionalization of mildly and strongly reduced graphene oxide with maleimide: an experimental and theoretical investigation of the Diels–Alder [4+ 2] cycloaddition … A Ferretti, S Sinha, L Sagresti, E Araya-Hermosilla, M Prato, V Mattoli, ... Physical Chemistry Chemical Physics 24 (4), 2491-2503, 2022 | 5 | 2022 |
Photoinduced azobenzene-modified DNA dehybridization: insights into local and cooperativity effects from a molecular dynamics study N Barbosa, L Sagresti, G Brancato Physical Chemistry Chemical Physics 23 (44), 25170-25179, 2021 | 5 | 2021 |
Chanalyzer: A computational geometry approach for the analysis of protein channel shape and dynamics A Raffo, L Gagliardi, U Fugacci, L Sagresti, S Grandinetti, G Brancato, ... Frontiers in molecular biosciences 9, 933924, 2022 | 2 | 2022 |
Thermodynamics of Metal–Acetate Interactions M Jafari, Z Li, LF Song, L Sagresti, G Brancato, KM Merz Jr The Journal of Physical Chemistry B 128 (3), 684-697, 2024 | 1 | 2024 |
Stochastic Model of Solvent Exchange in the First Coordination Shell of Aqua Ions L Sagresti, L Peri, G Ceccarelli, G Brancato Journal of chemical theory and computation 18 (5), 3164-3173, 2022 | 1 | 2022 |
Charge-flow profiles along curvilinear paths: A flexible scheme for the analysis of charge displacement upon intermolecular interactions L Sagresti, S Rampino Molecules 26 (21), 6409, 2021 | 1 | 2021 |
Simulating Metal-Imidazole Complexes Z Li, S Bhowmik, L Sagresti, G Brancato, M Smith, D Benson, P Li, K Merz | | 2024 |