Laura Scalvini

24PUBLICATIONS
74CO-AUTHORS
Immunogenetics (incl. genetic immunology)Biomolecular modelling and designCharacterisation of biological macromoleculesBasic pharmacologyCheminformatics and quantitative structure-activity relationships
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Publications (24)

|Feb 20, 2025
Spirotetrahydroisoquinoline-Based Histone Deacetylase Inhibitors as New Antifibrotic Agents: Biological Evaluation in Human Fibroblasts from Bronchoalveolar Lavages of Idiopathic Pulmonary Fibrosis Patients.

Anna Fontana, Laura Bergantini, Gabriele Carullo

|Jan 17, 2025
JAK3 Inhibitors: Covalent and Noncovalent Interactions of a Cyanamide Group Investigated by Multiscale Free-Energy Simulations.

Laura Scalvini, Daniele Pala, Alberto Cuzzolin

|Apr 12, 2024
Binding and unbinding of potent melatonin receptor ligands: Mechanistic simulations and experimental evidence.

Annalida Bedini, Gian Marco Elisi, Fabiola Fanini

|Nov 01, 2023
Molecular Determinants of EphA2 and EphB2 Antagonism Enable the Design of Ligands with Improved Selectivity.

Lorenzo Guidetti, Alfonso Zappia, Laura Scalvini

|Apr 13, 2023
Unbinding Kinetics of Muscarinic M3 Receptor Antagonists Explained by Metadynamics Simulations.

Francesca Galvani, Daniele Pala, Alberto Cuzzolin

|Feb 10, 2023
Mechanistic Modeling of Lys745 Sulfonylation in EGFR C797S Reveals Chemical Determinants for Inhibitor Activity and Discriminates Reversible from Irreversible Agents.

Kemel Arafet, Laura Scalvini, Francesca Galvani

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Frequent Collaborators

19 joint publications

Marco Mor

16 joint publications

Alessio Lodola

14 joint publications

Silvia Rivara

7 joint publications

Gilberto Spadoni