| Is the rigidity of SARS-CoV-2 spike receptor-binding motif the hallmark for its enhanced infectivity? Insights from all-atom simulations A Spinello, A Saltalamacchia, A Magistrato The journal of physical chemistry letters 11 (12), 4785-4790, 2020 | 163 | 2020 |
| Toward a rationale for the PTC124 (Ataluren) promoted readthrough of premature stop codons: a computational approach and GFP-reporter cell-based assay L Lentini, R Melfi, A Di Leonardo, A Spinello, G Barone, A Pace, ... Molecular pharmaceutics 11 (3), 653-664, 2014 | 103 | 2014 |
| Selective G-quadruplex stabilizers: Schiff-base metal complexes with anticancer activity A Terenzi, R Bonsignore, A Spinello, C Gentile, A Martorana, C Ducani, ... RSC advances 4 (63), 33245-33256, 2014 | 99 | 2014 |
| Nickel (II), copper (II) and zinc (II) metallo-intercalators: structural details of the DNA-binding by a combined experimental and computational investigation A Lauria, R Bonsignore, A Terenzi, A Spinello, F Giannici, A Longo, ... Dalton Transactions 43 (16), 6108-6119, 2014 | 97 | 2014 |
| All-atom simulations disentangle the functional dynamics underlying gene maturation in the intron lariat spliceosome L Casalino, G Palermo, A Spinello, U Rothlisberger, A Magistrato Proceedings of the National Academy of Sciences 115 (26), 6584-6589, 2018 | 74 | 2018 |
| A computational assay of estrogen receptor α antagonists reveals the key common structural traits of drugs effectively fighting refractory breast cancers M Pavlin, A Spinello, M Pennati, N Zaffaroni, S Gobbi, A Bisi, G Colombo, ... Scientific reports 8 (1), 649, 2018 | 74 | 2018 |
| Enhancement of premature stop codon readthrough in the CFTR gene by Ataluren (PTC124) derivatives I Pibiri, L Lentini, R Melfi, G Gallucci, A Pace, A Spinello, G Barone, ... European journal of medicinal chemistry 101, 236-244, 2015 | 70 | 2015 |
| Molecular basis for endocrine disruption by pesticides targeting aromatase and estrogen receptor C Zhang, T Schilirò, M Gea, S Bianchi, A Spinello, A Magistrato, G Gilardi, ... International Journal of Environmental Research and Public Health 17 (16), 5664, 2020 | 61 | 2020 |
| Circular dichroism of DNA G-quadruplexes: combining modeling and spectroscopy to unravel complex structures H Gattuso, A Spinello, A Terenzi, X Assfeld, G Barone, A Monari The Journal of Physical Chemistry B 120 (12), 3113-3121, 2016 | 58 | 2016 |
| Frontiers of metal-coordinating drug design G Palermo, A Spinello, A Saha, A Magistrato Expert opinion on drug discovery 16 (5), 497-511, 2021 | 52 | 2021 |
| G-quadruplex vs. duplex-DNA binding of nickel (II) and zinc (II) Schiff base complexes R Bonsignore, A Terenzi, A Spinello, A Martorana, A Lauria, AM Almerico, ... Journal of Inorganic Biochemistry 161, 115-121, 2016 | 50 | 2016 |
| Metal ions and metal complexes in Alzheimer’s disease A Spinello, R Bonsignore, G Barone, B K. Keppler, A Terenzi Current pharmaceutical design 22 (26), 3996-4010, 2016 | 45 | 2016 |
| Rational design of allosteric modulators of the aromatase enzyme: An unprecedented therapeutic strategy to fight breast cancer A Spinello, S Martini, F Berti, M Pennati, M Pavlin, J Sgrignani, G Grazioso, ... European journal of medicinal chemistry 168, 253-262, 2019 | 44 | 2019 |
| The interaction of Schiff Base complexes of nickel (II) and zinc (II) with duplex and G-quadruplex DNA R Bonsignore, F Russo, A Terenzi, A Spinello, A Lauria, G Gennaro, ... Journal of inorganic biochemistry 178, 106-114, 2018 | 41 | 2018 |
| Metal complex–DNA binding: Insights from molecular dynamics and DFT/MM calculations A Spinello, A Terenzi, G Barone Journal of inorganic biochemistry 124, 63-69, 2013 | 40 | 2013 |
| Molecular recognition of naphthalene diimide ligands by telomeric quadruplex-DNA: The importance of the protonation state and mediated hydrogen bonds A Spinello, G Barone, J Grunenberg Physical Chemistry Chemical Physics 18 (4), 2871-2877, 2016 | 38 | 2016 |
| Paracentrin 1, a synthetic antimicrobial peptide from the sea-urchin Paracentrotus lividus, interferes with staphylococcal and Pseudomonas aeruginosa biofilm … D Schillaci, MG Cusimano, A Spinello, G Barone, D Russo, M Vitale, ... AmB Express 4, 1-9, 2014 | 37 | 2014 |
| A Synthetic Derivative of Antimicrobial Peptide Holothuroidin 2 from Mediterranean Sea Cucumber (Holothuria tubulosa) in the Control of Listeria monocytogenes MG Cusimano, A Spinello, G Barone, D Schillaci, S Cascioferro, ... Marine drugs 17 (3), 159, 2019 | 36 | 2019 |
| The inhibition of glycerol permeation through aquaglyceroporin-3 induced by mercury (II): A molecular dynamics study A Spinello, A De Almeida, A Casini, G Barone Journal of inorganic biochemistry 160, 78-84, 2016 | 36 | 2016 |
| Exploiting cryo-EM structural information and all-atom simulations to decrypt the molecular mechanism of splicing modulators J Borisek, A Saltalamacchia, A Spinello, A Magistrato Journal of Chemical Information and Modeling 60 (5), 2510-2521, 2019 | 35 | 2019 |
Giampaolo BaroneProfessore Ordinario di Chimica, Università di Palermo在 unipa.it 的电子邮件经过验证