Paolo Conflitti

发表

Molecular Dynamics Simulations of the Host Defense Peptide Temporin L and Its Q3K Derivative: An Atomic Level View from Aggregation in Water to Bilayer Perturbation

A. Palleschi, G. Bocchinfuso, L. Stella, 2017, Molecules.

Identification of Cysteinyl-leukotriene-receptor 1 antagonists as ligands for the bile acid receptor GPBAR1.

A. Carino, S. Marchianò, V. Sepe, 2020, Biochemical pharmacology.

Discovery of a Potent and Orally Active Dual GPBAR1/CysLT1R Modulator for the Treatment of Metabolic Fatty Liver Disease

S. Marchianò, V. Sepe, Michele Biagioli, 2022, Frontiers in Pharmacology.

The Influence of pH on the Scleroglucan and Scleroglucan/Borax Systems

C. Mazzuca, A. Palleschi, C. Di Meo, 2017, Molecules.

Discovery of a Novel Class of Dual GPBAR1 Agonists–RORγt Inverse Agonists for the Treatment of IL-17-Mediated Disorders

S. Marchianò, V. Sepe, Michele Biagioli, 2023, ACS omega.

Aggregation propensity of Aib homo‐peptides of different length: an insight from molecular dynamics simulations

C. Toniolo, F. Formaggio, E. Placidi, 2014, Journal of peptide science : an official publication of the European Peptide Society.

Ubiquitylation of BBSome is required for ciliary assembly and signaling

Federica Moraca, B. Catalanotti, I. Conte, 2023, EMBO reports.

Enhanced EGFR Targeting Activity of Plasmonic Nanostructures with Engineered GE11 Peptide

A. Rosato, S. Mocellin, D. Nitti, 2017, Advanced healthcare materials.

Protein–ligand binding with the coarse-grained Martini model

Riccardo Alessandri, Sebastian Thallmair, Vittorio Limongelli, 2020, Nature Communications.

Structural Basis for Developing Multitarget Compounds Acting on Cysteinyl Leukotriene Receptor 1 and G-Protein-Coupled Bile Acid Receptor 1.

S. Marchianò, V. Sepe, Michele Biagioli, 2021, Journal of medicinal chemistry.

Aggregation propensity of therapeutic fibrin-homing pentapeptides: insights from experiments and molecular dynamics simulations.

C. Alemán, D. Zanuy, A. Palleschi, 2020, Soft matter.

Behavior of a Peptide During a Langmuir–Blodgett Compression Isotherm: A Molecular Dynamics Simulation Study

C. Mazzuca, A. Palleschi, M. Venanzi, 2018 .

Minute-timescale simulations of G Protein Coupled Receptor A2A activation mechanism reveal a receptor pseudo-active state

V. Limongelli, L. Marinelli, Paolo Conflitti, 2023, bioRxiv.

Structural basis of dimerization of chemokine receptors CCR5 and CXCR4

V. Limongelli, S. Motta, Paolo Conflitti, 2023, Nature communications.

Perspectives on Ligand/Protein Binding Kinetics Simulations: Force Fields, Machine Learning, Sampling, and User-Friendliness

V. Limongelli, S. Raniolo, Paolo Conflitti, 2023, Journal of chemical theory and computation.