Maria Letizia Barreca

Publication Activity (10 Years)

Years Active: 2014-2023
Publications (10 Years): 2

Top Topics

Neighboring Points

Clustering Large Data Sets

Top Venues

J. Chem. Inf. Model.

Publications

Deborah Palazzotti, Tommaso Felicetti, Stefano Sabatini, Stefano Moro, Maria Letizia Barreca, Mattia Sturlese, Andrea Astolfi
NorA Efflux Pump Recognizes 2-Phenylquinoline Inhibitors by Supervised Molecular Dynamics (SuMD) and Molecular Docking Simulations. J. Chem. Inf. Model. 63 (15) (2023)
Deborah Palazzotti, Martina Fiorelli, Stefano Sabatini, Serena Massari, Maria Letizia Barreca, Andrea Astolfi
Q-raKtion: A Semiautomated KNIME Workflow for Bioactivity Data Points Curation. J. Chem. Inf. Model. 62 (24) (2022)
Maria Letizia Barreca, Nunzio Iraci, Giuseppe Manfroni, Rosy Gaetani, Chiara Guercini, Stefano Sabatini, Oriana Tabarrini, Violetta Cecchetti
Accounting for Target Flexibility and Water Molecules by Docking to Ensembles of Target Structures: The HCV NS5B Palm Site I Inhibitors Case Study. J. Chem. Inf. Model. 54 (2) (2014)