The EU’s Per- and Polyfluoroalkyl Substances (PFAS) Ban: A Case of Policy over Science

por Spyrakis, Francesca, Dragani, Tommaso A.
Publicado 2023

Editorial: Computational methods for protein characterization: in memoriam of Donald Abraham

por Spyrakis, Francesca, Kellogg, Glen E.
Publicado 2023

Strigolactones, from Plants to Human Health: Achievements and Challenges

por Dell’Oste, Valentina, Spyrakis, Francesca, Prandi, Cristina
Publicado 2021

HINT, a code for understanding the interaction between biomolecules: a tribute to Donald J. Abraham

por Kellogg, Glen E., Marabotti, Anna, Spyrakis, Francesca, Mozzarelli, Andrea
Publicado 2023

Molecular Dynamics and Machine Learning Give Insights on the Flexibility–Activity Relationships in Tyrosine Kinome

por Majumdar, Sarmistha, Di Palma, Francesco, Spyrakis, Francesca, Decherchi, Sergio, Cavalli, Andrea
Publicado 2023

Can We Exploit β-Lactamases Intrinsic Dynamics for Designing More Effective Inhibitors?

por Gianquinto, Eleonora, Tondi, Donatella, D’Arrigo, Giulia, Lazzarato, Loretta, Spyrakis, Francesca
Publicado 2020

Energetics of the protein-DNA-water interaction

por Spyrakis, Francesca, Cozzini, Pietro, Bertoli, Chiara, Marabotti, Anna, Kellogg, Glen E, Mozzarelli, Andrea
Publicado 2007

Binding of Androgen- and Estrogen-Like Flavonoids to Their Cognate (Non)Nuclear Receptors: A Comparison by Computational Prediction

por D’Arrigo, Giulia, Gianquinto, Eleonora, Rossetti, Giulia, Cruciani, Gabriele, Lorenzetti, Stefano, Spyrakis, Francesca
Publicado 2021

Exploring Ligand Binding Domain Dynamics in the NRs Superfamily

por D’Arrigo, Giulia, Autiero, Ida, Gianquinto, Eleonora, Siragusa, Lydia, Baroni, Massimo, Cruciani, Gabriele, Spyrakis, Francesca
Publicado 2022

Cooperativity as quantification and optimization paradigm for nuclear receptor modulators

por de Vink, Pim J., Koops, Auke A., D'Arrigo, Giulia, Cruciani, Gabriele, Spyrakis, Francesca, Brunsveld, Luc
Publicado 2022

Iron Metabolism at the Interface between Host and Pathogen: From Nutritional Immunity to Antibacterial Development

por Marchetti, Marialaura, De Bei, Omar, Bettati, Stefano, Campanini, Barbara, Kovachka, Sandra, Gianquinto, Eleonora, Spyrakis, Francesca, Ronda, Luca
Publicado 2020

Antitarget, Anti-SARS-CoV-2 Leads, Drugs, and the Drug Discovery–Genetics Alliance Perspective

por Pozzi, Cecilia, Vanet, Anne, Francesconi, Valeria, Tagliazucchi, Lorenzo, Tassone, Giusy, Venturelli, Alberto, Spyrakis, Francesca, Mazzorana, Marco, Costi, Maria P., Tonelli, Michele
Publicado 2023

Bound Water at Protein-Protein Interfaces: Partners, Roles and Hydrophobic Bubbles as a Conserved Motif

por Ahmed, Mostafa H., Spyrakis, Francesca, Cozzini, Pietro, Tripathi, Parijat K., Mozzarelli, Andrea, Scarsdale, J. Neel, Safo, Martin A., Kellogg, Glen E.
Publicado 2011

N-[1,3-Dialkyl(aryl)-2-oxoimidazolidin-4-ylidene]-aryl(alkyl)sulphonamides as Novel Selective Human Cannabinoid Type 2 Receptor (hCB2R) Ligands; Insights into the Mechanism of Rece...

por Gianquinto, Eleonora, Sodano, Federica, Rolando, Barbara, Kostrzewa, Magdalena, Allarà, Marco, Mahmoud, Ali Mokhtar, Kumar, Poulami, Spyrakis, Francesca, Ligresti, Alessia, Chegaev, Konstantin
Publicado 2022

4-Amino-1,2,4-triazole-3-thione as a Promising Scaffold for the Inhibition of Serine and Metallo-β-Lactamases

por Linciano, Pasquale, Gianquinto, Eleonora, Montanari, Martina, Maso, Lorenzo, Bellio, Pierangelo, Cebrián-Sastre, Esmeralda, Celenza, Giuseppe, Blázquez, Jesús, Cendron, Laura, Spyrakis, Francesca, Tondi, Donatella
Publicado 2020

A generator of peroxynitrite activatable with red light

por Parisi, Cristina, Failla, Mariacristina, Fraix, Aurore, Menilli, Luca, Moret, Francesca, Reddi, Elena, Rolando, Barbara, Spyrakis, Francesca, Lazzarato, Loretta, Fruttero, Roberta, Gasco, Alberto, Sortino, Salvatore
Publicado 2021

Interaction of human hemoglobin and semi-hemoglobins with the Staphylococcus aureus hemophore IsdB: a kinetic and mechanistic insight

por Gianquinto, Eleonora, Moscetti, Ilaria, De Bei, Omar, Campanini, Barbara, Marchetti, Marialaura, Luque, F. Javier, Cannistraro, Salvatore, Ronda, Luca, Bizzarri, Anna Rita, Spyrakis, Francesca, Bettati, Stefano
Publicado 2019

Strigolactone Analogs Are Promising Antiviral Agents for the Treatment of Human Cytomegalovirus Infection

por Biolatti, Matteo, Blangetti, Marco, D’Arrigo, Giulia, Spyrakis, Francesca, Cappello, Paola, Albano, Camilla, Ravanini, Paolo, Landolfo, Santo, De Andrea, Marco, Prandi, Cristina, Dell’Oste, Valentina
Publicado 2020

Chemical Modulation of the 1-(Piperidin-4-yl)-1,3-dihydro-2H-benzo[d]imidazole-2-one Scaffold as a Novel NLRP3 Inhibitor

por Gastaldi, Simone, Boscaro, Valentina, Gianquinto, Eleonora, Sandall, Christina F., Giorgis, Marta, Marini, Elisabetta, Blua, Federica, Gallicchio, Margherita, Spyrakis, Francesca, MacDonald, Justin A., Bertinaria, Massimo
Publicado 2021

Repurposing the Trypanosomatidic GSK Kinetobox for the Inhibition of Parasitic Pteridine and Dihydrofolate Reductases

por Santucci, Matteo, Luciani, Rosaria, Gianquinto, Eleonora, Pozzi, Cecilia, Pisa, Flavio di, dello Iacono, Lucia, Landi, Giacomo, Tagliazucchi, Lorenzo, Mangani, Stefano, Spyrakis, Francesca, Costi, Maria Paola
Publicado 2021