Conformational Sampling of Small Molecules With iCon: Performance Assessment in Comparison With OMEGA

por Poli, Giulio, Seidel, Thomas, Langer, Thierry
Publicado 2018

Application of MM-PBSA Methods in Virtual Screening

por Poli, Giulio, Granchi, Carlotta, Rizzolio, Flavio, Tuccinardi, Tiziano
Publicado 2020

Three-Dimensional Interactions Analysis of the Anticancer Target c-Src Kinase with Its Inhibitors

por Jha, Vibhu, Macchia, Marco, Tuccinardi, Tiziano, Poli, Giulio
Publicado 2020

Development of a Fingerprint-Based Scoring Function for the Prediction of the Binding Mode of Carbonic Anhydrase II Inhibitors

por Poli, Giulio, Jha, Vibhu, Martinelli, Adriano, Supuran, Claudiu T., Tuccinardi, Tiziano
Publicado 2018

Three-Dimensional Analysis of the Interactions between hLDH5 and Its Inhibitors

por Poli, Giulio, Granchi, Carlotta, Aissaoui, Mohamed, Minutolo, Filippo, Tuccinardi, Tiziano
Publicado 2017

Development of a cheminformatics platform for selectivity analyses of carbonic anhydrase inhibitors

por Poli, Giulio, Galati, Salvatore, Martinelli, Adriano, Supuran, Claudiu T., Tuccinardi, Tiziano
Publicado 2019

MolBook UNIPI—Create, Manage, Analyze, and Share Your Chemical Data for Free

por Galati, Salvatore, Di Stefano, Miriana, Macchia, Marco, Poli, Giulio, Tuccinardi, Tiziano
Publicado 2023

Recent Advances in In Silico Target Fishing

por Galati, Salvatore, Di Stefano, Miriana, Martinelli, Elisa, Poli, Giulio, Tuccinardi, Tiziano
Publicado 2021

Extensive Reliability Evaluation of Docking-Based Target-Fishing Strategies

por Lapillo, Margherita, Tuccinardi, Tiziano, Martinelli, Adriano, Macchia, Marco, Giordano, Antonio, Poli, Giulio
Publicado 2019

Mealworm (Tenebrio molitor): Potential and Challenges to Promote Circular Economy

por Moruzzo, Roberta, Riccioli, Francesco, Espinosa Diaz, Salomon, Secci, Chiara, Poli, Giulio, Mancini, Simone
Publicado 2021

Novel 8-Substituted Coumarins That Selectively Inhibit Human Carbonic Anhydrase IX and XII

por Buran, Kerem, Bua, Silvia, Poli, Giulio, Önen Bayram, F. Esra, Tuccinardi, Tiziano, T. Supuran, Claudiu
Publicado 2019

Discovery of Novel µ-Opioid Receptor Inverse Agonist from a Combinatorial Library of Tetrapeptides through Structure-Based Virtual Screening

por Poli, Giulio, Dimmito, Marilisa Pia, Mollica, Adriano, Zengin, Gokhan, Benyhe, Sandor, Zador, Ferenc, Stefanucci, Azzurra
Publicado 2019

VenomPred: A Machine Learning Based Platform for Molecular Toxicity Predictions

por Galati, Salvatore, Di Stefano, Miriana, Martinelli, Elisa, Macchia, Marco, Martinelli, Adriano, Poli, Giulio, Tuccinardi, Tiziano
Publicado 2022

An in silico toolbox for the prediction of the potential pathogenic effects of missense mutations in the dimeric region of hRPE65

por Poli, Giulio, Demontis, Gian Carlo, Sodi, Andrea, Saba, Alessandro, Rizzo, Stanislao, Macchia, Marco, Tuccinardi, Tiziano
Publicado 2023

Aldose Reductase Differential Inhibitors in Green Tea

por Balestri, Francesco, Poli, Giulio, Pineschi, Carlotta, Moschini, Roberta, Cappiello, Mario, Mura, Umberto, Tuccinardi, Tiziano, Del Corso, Antonella
Publicado 2020

Predicting potentially pathogenic effects of hRPE65 missense mutations: a computational strategy based on molecular dynamics simulations

por Poli, Giulio, Barravecchia, Ivana, Demontis, Gian Carlo, Sodi, Andrea, Saba, Alessandro, Rizzo, Stanislao, Macchia, Marco, Tuccinardi, Tiziano
Publicado 2022

Identification of Human Dihydroorotate Dehydrogenase Inhibitor by a Pharmacophore-Based Virtual Screening Study

por Galati, Salvatore, Sainas, Stefano, Giorgis, Marta, Boschi, Donatella, Lolli, Marco L., Ortore, Gabriella, Poli, Giulio, Tuccinardi, Tiziano
Publicado 2022

Development of terphenyl-2-methyloxazol-5(4H)-one derivatives as selective reversible MAGL inhibitors

por Granchi, Carlotta, Caligiuri, Isabella, Bertelli, Eleonora, Poli, Giulio, Rizzolio, Flavio, Macchia, Marco, Martinelli, Adriano, Minutolo, Filippo, Tuccinardi, Tiziano
Publicado 2017

Design, Synthesis, Docking Studies and Monoamine Oxidase Inhibition of a Small Library of 1-acetyl- and 1-thiocarbamoyl-3,5-diphenyl-4,5-dihydro-(1H)-pyrazoles

por Guglielmi, Paolo, Carradori, Simone, Poli, Giulio, Secci, Daniela, Cirilli, Roberto, Rotondi, Giulia, Chimenti, Paola, Petzer, Anél, Petzer, Jacobus P.
Publicado 2019

Discovery of Monoacylglycerol Lipase (MAGL) Inhibitors Based on a Pharmacophore-Guided Virtual Screening Study

por Jha, Vibhu, Biagi, Marzia, Spinelli, Valeria, Di Stefano, Miriana, Macchia, Marco, Minutolo, Filippo, Granchi, Carlotta, Poli, Giulio, Tuccinardi, Tiziano
Publicado 2020