Publications by authors named "Angelo Spinello"

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Computational modeling and experimental validation of the interaction between tumor biomarker mesothelin and an engineered targeting protein with therapeutic activity.
Margherita Piccardi, Valeria Butera, Ignazio Sardo, Stefano Landi, Federica Gemignani, Angelo Spinello

Protein Sci· September 2025

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Rationalizing the structural basis of organic-platinum hybrid complexes binding towards quadruplex-duplex hybrids through all-atom simulations.
Salvatore Muscarella, Irene Treccarichi, Luisa D'Anna, Angelo Spinello

J Inorg Biochem· July 2025

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Epigallocatechin-3-gallate binds tandem RNA recognition motifs of TDP-43 and inhibits its aggregation.
Maria Agnese Morando, Vito D'Alessandro, Angelo Spinello, Martina Sollazzo, Elisa Monaca

Sci Rep· May 2025

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Unraveling the Molecular Basis for G-Quadruplex-Binders to ALS/FTD-Associated G4C2 Repeats of the C9orf72 Gene.
Luisa D'Anna, Darren Wragg, Daniela Mauro, Simona Rubino, Alessio Terenzi, Angelo Spinello

Chembiochem· April 2025

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Self-assembling Depsipeptides on Aggregation-Induced Emission Luminogens: A New Way to Create Programmable Nanovesicles and Soft Nanocarriers.
Carla Hernando-Muñoz, Andrea Revilla-Cuesta, Irene Abajo-Cuadrado, Camilla Andreini, Tomás Torroba, Angelo Spinello

ACS Appl Mater Interfaces· February 2025

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Resolving the Structure of a Guanine Quadruplex in TMPRSS2 Messenger RNA by Circular Dichroism and Molecular Modeling.
Luisa D'Anna, Aurane Froux, Aurianne Rainot, Angelo Spinello, Ugo Perricone

Chemistry· December 2024

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Novel half Salphen cobalt(III) complexes: synthesis, DNA binding and anticancer studies.
Riccardo Bonsignore, Elisa Trippodo, Roberto Di Gesù, Anna Paola Carreca, Simona Rubino, Angelo Spinello

Dalton Trans· April 2024

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How the Metal Ion Affects the H NMR Chemical Shift Values of Schiff Base Metal Complexes: Rationalization by DFT Calculations.
Valeria Butera, Luisa D'Anna, Simona Rubino, Riccardo Bonsignore, Angelo Spinello

J Phys Chem A· November 2023

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The avidin-theophylline complex: A structural and computational study.
Angelo Spinello, Fabio Lapenta, Matteo De March

Proteins· October 2023

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Cancer-Related Mutations Alter RNA-Driven Functional Cross-Talk Underlying Premature-Messenger RNA Recognition by Splicing Factor SF3b.
Angelo Spinello, Pavel Janos, Riccardo Rozza, Alessandra Magistrato

J Phys Chem Lett· July 2023

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Mechanism of the Covalent Inhibition of Human Transmembrane Protease Serine 2 as an Original Antiviral Strategy.
Angelo Spinello, Luisa D'Anna, Emmanuelle Bignon, Tom Miclot, Stéphanie Grandemange

J Phys Chem B· July 2023

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Predicting the Three-Dimensional Structure of the c- Proto-Oncogene Promoter and the Dynamics of Its Strongly Coupled Guanine Quadruplexes.
Emmanuelle Bignon, Angelo Spinello, Tom Miclot, Luisa D'Anna, Cosimo Ducani

J Phys Chem Lett· May 2023

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Switching from Aromatase Inhibitors to Dual Targeting Flavonoid-Based Compounds for Breast Cancer Treatment.
Silvia Gobbi, Silvia Martini, Riccardo Rozza, Angelo Spinello, Jessica Caciolla

Molecules· March 2023

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Single-digit nanomolar inhibitors lock the aromatase active site via a dualsteric targeting strategy.
Jessica Caciolla, Silvia Martini, Angelo Spinello, Federica Belluti, Alessandra Bisi

Eur J Med Chem· December 2022

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A Novel Peptide with Antifungal Activity from Red Swamp Crayfish .
Diletta Punginelli, Valentina Catania, Mirella Vazzana, Manuela Mauro, Angelo Spinello

Antibiotics (Basel)· December 2022

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Anticancer Activity, Reduction Mechanism and G-Quadruplex DNA Binding of a Redox-Activated Platinum(IV)-Salphen Complex.
Vincenzo Vigna, Stefano Scoditti, Angelo Spinello, Gloria Mazzone, Emilia Sicilia

Int J Mol Sci· December 2022

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Role of computational and structural biology in the development of small-molecule modulators of the spliceosome.
Riccardo Rozza, Pavel Janoš, Angelo Spinello, Alessandra Magistrato

Expert Opin Drug Discov· October 2022

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Molecular Basis of SARS-CoV-2 Nsp1-Induced Immune Translational Shutdown as Revealed by All-Atom Simulations.
Jure Borišek, Angelo Spinello, Alessandra Magistrato

J Phys Chem Lett· December 2021

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Balanced dual acting compounds targeting aromatase and estrogen receptor α as an emerging therapeutic opportunity to counteract estrogen responsive breast cancer.
Jessica Caciolla, Silvia Martini, Angelo Spinello, Matic Pavlin, Eleonora Turrini

Eur J Med Chem· November 2021

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Investigating the Molecular Mechanism of H3B-8800: A Splicing Modulator Inducing Preferential Lethality in Spliceosome-Mutant Cancers.
Angelo Spinello, Jure Borišek, Luca Malcovati, Alessandra Magistrato

Int J Mol Sci· October 2021

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Computing Metal-Binding Proteins for Therapeutic Benefit.
Angelo Spinello, Jure Borišek, Matic Pavlin, Pavel Janoš, Alessandra Magistrato

ChemMedChem· July 2021

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Allosteric Cross-Talk among Spike's Receptor-Binding Domain Mutations of the SARS-CoV-2 South African Variant Triggers an Effective Hijacking of Human Cell Receptor.
Angelo Spinello, Andrea Saltalamacchia, Jure Borišek, Alessandra Magistrato

J Phys Chem Lett· July 2021

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Molecular Mechanisms of the Blockage of Glioblastoma Motility.
Jing Xu, Federica Simonelli, Xiaoyun Li, Angelo Spinello, Sara Laporte

J Chem Inf Model· June 2021

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Frontiers of metal-coordinating drug design.
Giulia Palermo, Angelo Spinello, Aakash Saha, Alessandra Magistrato

Expert Opin Drug Discov· May 2021

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All-atom simulations to studying metallodrugs/target interactions.
Pavel Janoš, Angelo Spinello, Alessandra Magistrato

Curr Opin Chem Biol· April 2021

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