Sirakanyan, S.N.; Kartsev, V.A.; Spinelli, D.; Geronikaki, A.; Hakobyan, E.K.; Panosyan, H.A.; Calvaresi, M.; Boga, C.; Hovakimyan, A.A., Reactivity in 7-benzyl-2,7-naphthyridine derivatives: Nucleophilic substitutions, rearrangements, heterocyclizations and related reactions, «CURRENT ORGANIC CHEMISTRY», 2017, 21, pp. 1131 - 1141 [Scientific article]
Bottoni, Andrea; Cahiez, Gerard; Calvaresi, Matteo; Moyeux, Alban; Giacinto, Pietro; Miscione, Gian Pietro, A mechanistic insights into manganese-catalyzed oxidative homocoupling reactions of Grignard reagents: A computational DFT investigation, «JOURNAL OF ORGANOMETALLIC CHEMISTRY», 2016, 814, pp. 25 - 34 [Scientific article]
Di Giosia, Matteo; Polishchuk, Iryna; Weber, Eva; Fermani, Simona; Pasquini, Luca; Pugno, Nicola M.; Zerbetto, Francesco; Montalti, Marco; Calvaresi, Matteo; Falini, Giuseppe; Pokroy, Boaz, Bioinspired Nanocomposites: Ordered 2D Materials Within a 3D Lattice, «ADVANCED FUNCTIONAL MATERIALS», 2016, 26, pp. 5569 - 5575 [Scientific article]Open Access
Giacinto, Pietro; Zerbetto, Francesco; Bottoni, Andrea; Calvaresi, Matteo, CNT-Confinement Effects on the Menshutkin SN2 Reaction: The Role of Nonbonded Interactions, «JOURNAL OF CHEMICAL THEORY AND COMPUTATION», 2016, 12, pp. 4082 - 4092 [Scientific article]
El Garah, M.; Santana Bonilla, A.; Ciesielski, A.; Gualandi, A.; Mengozzi, L.; Fiorani, A.; Iurlo, M.; Marcaccio, M.; Gutierrez, R.; Rapino, S.; Calvaresi, M.; Zerbetto, F.; Cuniberti, G.; Cozzi, P.G.; Paolucci, F.; Samorì, P, Molecular design driving tetraporphyrin self-assembly on graphite: A joint STM, electrochemical and computational study, «NANOSCALE», 2016, 8, pp. 13678 - 13686 [Scientific article]
Bonacchi, Sara; Cantelli, Andrea; Battistelli, Giulia; Guidetti, Gloria; Calvaresi, Matteo; Manzi, Jeannette; Gabrielli, Luca; Ramadori, Federico; Gambarin, Alessandro; Mancin, Fabrizio; Montalti, Marco, Photoswitchable NIR-Emitting Gold Nanoparticles, «ANGEWANDTE CHEMIE. INTERNATIONAL EDITION», 2016, 55, pp. 11064 - 11068 [Scientific article]Open Access
Milli, Lorenzo; Zanna, Nicola; Merlettini, Andrea; Di Giosia, Matteo; Calvaresi, Matteo; Focarete, Maria Letizia; Tomasini, Claudia, Pseudopeptide-Based Hydrogels Trapping Methylene Blue and Eosin Y, «CHEMISTRY-A EUROPEAN JOURNAL», 2016, 22, pp. 12106 - 12112 [Scientific article]
Calvaresi, Matteo; Eckhart, Leopold; Alibardi, Lorenzo, The molecular organization of the beta-sheet region in Corneous beta-proteins (beta-keratins) of sauropsids explains its stability and polymerization into filaments, «JOURNAL OF STRUCTURAL BIOLOGY», 2016, 194, pp. 282 - 291 [Scientific article]
Marforio, Tainah Dorina; Bottoni, Andrea; Calvaresi, Matteo; Fabbri, Daniele; Giacinto, Pietro; Zerbetto, Francesco, The Reaction Pathway of Cellulose Pyrolysis to a Multifunctional Chiral Building Block: The Role of Water Unveiled by a DFT Computational Investigation, «CHEMPHYSCHEM», 2016, 17, pp. 3948 - 3953 [Scientific article]
Zaffagnini, Mirko; Fermani, Simona; Calvaresi, Matteo; Orrù, Roberto; Iommarini, Luisa; Sparla, Francesca; Falini, Giuseppe; Bottoni, Andrea; Trost, Paolo, TUNING CYSTEINE REACTIVITY AND SULFENIC ACID STABILITY BY PROTEIN MICROENVIRONMENT IN GLYCERALDEHYDE-3-PHOSPHATE DEHYDROGENASES OF ARABIDOPSIS THALIANA, «ANTIOXIDANTS & REDOX SIGNALING», 2016, 24, pp. 502 - 517 [Scientific article]Open Access
Bottoni, Andrea; Calvaresi, Matteo; Cosimelli, Barbara; Mazzanti, Andrea; Rambaldi, Mirella; Spinelli, Domenico, An Unexpected Pathway to Enantiomerization of Hemithioketals in Toluene Involving a Dimeric Transition State: A Combined Experimental and Computational Study, «EUROPEAN JOURNAL OF ORGANIC CHEMISTRY», 2015, 20, pp. 4353 - 4357 [Scientific article]
Calvaresi M; Furini S; Domene C; Bottoni A; Zerbetto F., Blocking the passage: C60 geometrically clogs K+ channels, «ACS NANO», 2015, 9, pp. 4827 - 4834 [Scientific article]Open Access
Magnabosco, G.; Di Giosia, M.; Polishchuk, I.; Weber, E.; Fermani, S.; Bottoni, A.; Zerbetto, F.; Pelicci, P.G.; Pokroy, B.; Rapino, S.; Falini, G.; Calvaresi, M., Calcite Single Crystals as Hosts for Atomic-Scale Entrapment and Slow Release of Drugs, «ADVANCED HEALTHCARE MATERIALS», 2015, 4, pp. 1510 - 1516 [Scientific article]
Marforio, T.D.; Giacinto, P.; Bottoni, A.; Calvaresi, M., Computational Evidence for the Catalytic Mechanism of Tyrosylprotein Sulfotransferases: A Density Functional Theory Investigation, «BIOCHEMISTRY», 2015, 54, pp. 4404 - 4410 [Scientific article]
Magnabosco G.; Di Giosia M.; Polishchuk I.; Weber E.; Fermani S.; Bottoni A.; Zerbetto F.; Pelicci P.G.; Pokroy B.; Rapino S.; Falini G.; Calvaresi M., Correction to Calcite Single Crystals as Hosts for Atomic-Scale Entrapment and Slow Release of Drugs [Adv. Healthcare Mater. 4, (2015), 1510-1516] doi: 10.1002/adhm.201500170, «ADVANCED HEALTHCARE MATERIALS», 2015, 4, pp. 1899 - 1899 [Scientific article]
