BARCARO, GIOVANNI Statistiche
BARCARO, GIOVANNI
Anti-Cancer Warfare: A New Hope. ReaxFF MDs Disclose the Stages of Biohybrid Nano Weapons Preparation, Structure, Dynamics, and Final Action.
2023-01-01 Trouki, Cheherazade; Barcaro, Giovanni; Monti, Susanna
Different Dynamic Behavior of Methyl Groups in Crystalline Carbimazole as Revealed by a Multitechnique Experimental and Theoretical Approach
2023-01-01 Scarperi, A.; Carignani, E.; Martini, F.; Embs, J. P.; Wasicki, J.; Barcaro, G.; Geppi, M.; Pajzderska, A.
Different Dynamic Behavior of Methyl Groups in Crystalline Carbimazole as Revealed by a Multitechnique Experimental and Theoretical Approach
2023-01-01 Scarperi, A; Carignani, E; Martini, F; Embs, Jp; Wasicki, J; Barcaro, G; Geppi, M; Pajzderska, A
Disclosing gate-opening/closing events inside a flexible metal-organic framework loaded with CO2 by reactive and essential dynamics
2023-01-01 Monti, S.; Trouki, C.; Barcaro, G.
Inorganic nanoparticles as vehicles to deliver anti-cancer drugs: reactive molecular dynamics simulations can disclose all the steps of their action
2023-01-01 Trouki, C.; Barcaro, G.; Monti, S.
ReaxFF Molecular Dynamics Simulations to Explore the Structure and Drug Delivery Process of ZnO Nanoparticles
2023-01-01 Trouki, C.; Barcaro, G.; Monti, S.
Stability and potential degradation of the α′,β′-epoxyketone pharmacophore on ZnO nanocarriers: insights from reactive molecular dynamics and density functional theory calculations
2023-01-01 Trouki, C.; Monti, S.; Barcaro, G.
The dynamics of drug delivery by ReaxFF MD
2023-01-01 Monti, S.; Trouki, C.; Barcaro, G.
Exploring the mechanisms of drug-delivery by decorated ZnO nanoparticles through predictive ReaxFF molecular dynamics simulations
2022-01-01 Trouki, Cheherazade; Barcaro, Giovanni; Monti, Susanna
Structure and dynamics of perylene bisimide pigments for "cool" organic coatings by solid-state NMR: A combined experimental and DFT study
2020-01-01 Martini, F.; Geppi, M.; Barcaro, G.; Monti, S.; Contiero, L.; Ruggeri, G.; Lessi, M.; Pucci, A.; Bellina, F.; Borsacchi, S.