Modeling Epac1 interactions with the allosteric inhibitor AM-001 by co-solvent molecular dynamics. - Marianna Bufano; Marion Laudette; Jean-Paul Blondeau; Frank Lezoualc'h; Marianna Nalli; Romano Silvestri; Andrea Brancale; Antonio Coluccia (J. Comput. Aided Mol. Des., 2020)

Retrospective Benchmarking and Novel Shape-Pharmacophore Based Implementation of the MORLD Method for the Autonomous Optimization of 3-Aroyl-1,4-diarylpyrroles (ARDAP). - Pietro Sciò; Marianna Bufano; Romano Silvestri; Antonio Coluccia (J. Chem. Inf. Model., 2025)