Rino Ragno

Publication Activity (10 Years)

Years Active: 2006-2024
Publications (10 Years): 7

Top Topics

Subcellular Localization

Chemical Compounds

Top Venues

J. Chem. Inf. Model.

J. Comput. Aided Mol. Des.

Publications

Michela Proietti, Alessio Ragno, Biagio La Rosa, Rino Ragno, Roberto Capobianco
Explainable AI in drug discovery: self-interpretable graph neural network for molecular property prediction using concept whitening. Mach. Learn. 113 (4) (2024)
Eleonora Proia, Alessio Ragno, Lorenzo Antonini, Manuela Sabatino, Milan Mladenovic, Roberto Capobianco, Rino Ragno
Ligand-based and structure-based studies to develop predictive models for SARS-CoV-2 main protease inhibitors through the 3d-qsar.com portal. J. Comput. Aided Mol. Des. 36 (7) (2022)
Rino Ragno, Anna Minarini, Eleonora Proia, Antonini Lorenzo, Andrea Milelli, Vincenzo Tumiatti, Marco Fiore, Pasquale Fino, Lavinia Rutigliano, Rossella Fioravanti, Tomoaki Tahara, Elena Pacella, Antonio Greco, Gianluca Canettieri, Maria Luisa Di Paolo, Enzo Agostinelli
Bovine Serum Amine Oxidase and Polyamine Analogues: Chemical Synthesis and Biological Evaluation Integrated with Molecular Docking and 3-D QSAR Studies. J. Chem. Inf. Model. 62 (16) (2022)
Nezrina Mihovic, Nevena Tomasevic, Sanja Matic, Marina M. Mitrovic, Danijela A. Kostic, Manuela Sabatino, Lorenzo Antonini, Rino Ragno, Milan Mladenovic
Human Estrogen Receptor α Antagonists. Part 1: 3-D QSAR-Driven Rational Design of Innovative Coumarin-Related Antiestrogens as Breast Cancer Suppressants through Structure-Based and Ligand-Based Studies. J. Chem. Inf. Model. 61 (10) (2021)
Rino Ragno
www.3d-qsar.com: a web portal that brings 3-D QSAR to all electronic devices - the Py-CoMFA web application as tool to build models from pre-aligned datasets. J. Comput. Aided Mol. Des. 33 (9) (2019)
Manuela Sabatino, Dante Rotili, Alexandros Patsilinakos, Mariantonietta Forgione, Daniela Tomaselli, Fréderic Alby, Paola B. Arimondo, Antonello Mai, Rino Ragno
Disruptor of telomeric silencing 1-like (DOT1L): disclosing a new class of non-nucleoside inhibitors by means of ligand-based and structure-based approaches. J. Comput. Aided Mol. Des. 32 (3) (2018)
Milan Mladenovic, Alexandros Patsilinakos, Adele Pirolli, Manuela Sabatino, Rino Ragno
-Chromen-2-One Core: Structure-Based and Ligand-Based Derived Three-Dimensional Quantitative Structure-Activity Relationships Predictive Models. J. Chem. Inf. Model. 57 (4) (2017)
Rino Ragno, Flavio Ballante, Adele Pirolli, Richard B. Wickersham III, Alexandros Patsilinakos, Stéphanie Hesse, Enrico Perspicace, Gilbert Kirsch
Vascular endothelial growth factor receptor-2 (VEGFR-2) inhibitors: development and validation of predictive 3-D QSAR models through extensive ligand- and structure-based approaches. J. Comput. Aided Mol. Des. 29 (8) (2015)
Antonia Caroli, Flavio Ballante, Richard B. Wickersham III, Federico Corelli, Rino Ragno
Hsp90 Inhibitors, Part 2: Combining Ligand-Based and Structure-Based Approaches for Virtual Screening Application. J. Chem. Inf. Model. 54 (3) (2014)
Flavio Ballante, Antonia Caroli, Richard B. Wickersham III, Rino Ragno
Hsp90 Inhibitors, Part 1: Definition of 3-D QSAutogrid/R Models as a Tool for Virtual Screening. J. Chem. Inf. Model. 54 (3) (2014)
Laura Friggeri, Flavio Ballante, Rino Ragno, Ira Musmuca, Daniela De Vita, Fabrizio Manetti, Mariangela Biava, Luigi Scipione, Roberto Di Santo, Roberta Costi, Marta Feroci, Silvano Tortorella
Pharmacophore Assessment Through 3-D QSAR: Evaluation of the Predictive Ability on New Derivatives by the Application on a Series of Antitubercular Agents. J. Chem. Inf. Model. 53 (6) (2013)
Laura Silvestri, Flavio Ballante, Antonello Mai, Garland R. Marshall, Rino Ragno
Histone Deacetylase Inhibitors: Structure-Based Modeling and Isoform-Selectivity Prediction. J. Chem. Inf. Model. 52 (8) (2012)
Flavio Ballante, Rino Ragno
3-D QSAutogrid/R: An Alternative Procedure To Build 3-D QSAR Models. Methodologies and Applications. J. Chem. Inf. Model. 52 (6) (2012)
Flavio Ballante, Ira Musmuca, Garland R. Marshall, Rino Ragno
Comprehensive model of wild-type and mutant HIV-1 reverse transciptases. J. Comput. Aided Mol. Des. 26 (8) (2012)
Ira Musmuca, Antonia Caroli, Antonello Mai, Neerja Kaushik-Basu, Payal Arora, Rino Ragno
Screening of New Hepatitis C Virus NS5B Polymerase Inhibitors. J. Chem. Inf. Model. 50 (4) (2010)
Ira Musmuca, Silvia Simeoni, Antonia Caroli, Rino Ragno
Small-Molecule Interferon Inducers. Toward the Comprehension of the Molecular Determinants through Ligand-Based Approaches. J. Chem. Inf. Model. 49 (7) (2009)
Fabrizio Manetti, Cristina Tintori, Mercedes Armand-Ugón, Imma Clotet-Codina, Silvio Massa, Rino Ragno, José A. Esté, Maurizio Botta
A Combination of Molecular Dynamics and Docking Calculations to Explore the Binding Mode of ADS-J1, a Polyanionic Compound Endowed with Anti-HIV-1 Activity. J. Chem. Inf. Model. 46 (3) (2006)
Rino Ragno, Silvia Simeoni, Sergio Valente, Silvio Massa, Antonello Mai
3-D QSAR Studies on Histone Deacetylase Inhibitors. A GOLPE/GRID Approach on Different Series of Compounds. J. Chem. Inf. Model. 46 (3) (2006)