Open3DALIGN: an open-source software aimed at unsupervised ligand alignment. - Paolo Tosco; Thomas Balle; Fereshteh Shiri (J. Comput. Aided Mol. Des., 2011)

Brute-force pharmacophore assessment and scoring with Open3DQSAR. - Paolo Tosco; Thomas Balle (J. Cheminformatics, 2011)

COSMOsar3D: Molecular Field Analysis Based on Local COSMO σ-Profiles. - Andreas Klamt; Michael Thormann; Karin Wichmann; Paolo Tosco (J. Chem. Inf. Model., 2012)

A 3D-QSAR-Driven Approach to Binding Mode and Affinity Prediction. - Paolo Tosco; Thomas Balle (J. Chem. Inf. Model., 2012)

3D-QSAR reloaded: Open3DALIGN meets COSMOsar3D. - Paolo Tosco; Andreas Klamt (J. Cheminformatics, 2013)

Bringing the MMFF force field to the RDKit: implementation and validation. - Paolo Tosco; Nikolaus Stiefl; Gregory A. Landrum (J. Cheminformatics, 2014)

The integration of Open3DTOOLS into the RDKit and KNIME. - Paolo Tosco; Nikolaus Stiefl; Gregory A. Landrum (J. Cheminformatics, 2014)

Assessment of Binding Affinity via Alchemical Free-Energy Calculations. - Maximilian Kuhn; Stuart Firth-Clark; Paolo Tosco; Antonia S. J. S. Mey; Mark Mackey; Julien Michel (J. Chem. Inf. Model., 2020)

Hybrid Alchemical Free Energy/Machine-Learning Methodology for the Computation of Hydration Free Energies. - Jenke Scheen; Wilson Wu; Antonia S. J. S. Mey; Paolo Tosco; Mark Mackey; Julien Michel (J. Chem. Inf. Model., 2020)

Comparative Analysis of Neural Networks Techniques for Lithium-ion Battery SOH Estimation. - Alessandro Aliberti; Filippo Boni; Alessandro Perol; Marco Zampolli; Rémi Jacques Philibert Jaboeuf; Paolo Tosco; Enrico Macii; Edoardo Patti (COMPSAC, 2022)

An Electric Vehicle Simulator for Realistic Battery Signals Generation from Data-sheet and Real-world Data. - Raimondo Gallo; Alessandro Aliberti; Edoardo Patti; Gianluca Bussolo; Marco Zampolli; Rémi Jacques Philibert Jaboeuf; Paolo Tosco (COMPSAC, 2023)

A Novel Procedure for Real-Time SOH Estimation of EV Battery Packs Based on Time Series Extrinsic Regression. - Raimondo Gallo; Tommaso Monopoli; Marco Zampolli; Rémi Jacques Philibert Jaboeuf; Paolo Tosco; Edoardo Patti; Alessandro Aliberti (IEEE Access, 2025)