| Experimental evidence of chemical components in the bonding of helium and neon with neutral molecules D Cappelletti, A Bartocci, F Grandinetti, S Falcinelli, L Belpassi, ... Chemistry–A European Journal 21 (16), 6234-6240, 2015 | 54 | 2015 |
| Stereodynamics in the collisional autoionization of water, ammonia, and hydrogen sulfide with metastable rare gas atoms: competition between intermolecular halogen and hydrogen … S Falcinelli, A Bartocci, S Cavalli, F Pirani, F Vecchiocattivi Chemistry–A European Journal 22 (2), 764-771, 2016 | 49 | 2016 |
| Modeling the intermolecular interactions and characterization of the dynamics of collisional autoionization processes S Falcinelli, M Rosi, P Candori, F Vecchiocattivi, A Bartocci, A Lombardi, ... Computational Science and Its Applications–ICCSA 2013: 13th International …, 2013 | 46 | 2013 |
| Collisional autoionization dynamics of Ne∗(3P2, 0)–H2O N Balucani, A Bartocci, B Brunetti, P Candori, S Falcinelli, F Palazzetti, ... Chemical Physics Letters 546, 34-39, 2012 | 42 | 2012 |
| Catching the role of anisotropic electronic distribution and charge transfer in halogen bonded complexes of noble gases A Bartocci, L Belpassi, D Cappelletti, S Falcinelli, F Grandinetti, ... The Journal of Chemical Physics 142 (18), 2015 | 38 | 2015 |
| H 2 O–CH 4 and H 2 S–CH 4 complexes: a direct comparison through molecular beam experiments and ab initio calculations D Cappelletti, A Bartocci, F Frati, LF Roncaratti, L Belpassi, F Tarantelli, ... Physical Chemistry Chemical Physics 17 (45), 30613-30623, 2015 | 23 | 2015 |
| A Martini coarse-grained model of the calcein fluorescent dye S Salassi, F Simonelli, A Bartocci, G Rossi Journal of Physics D: Applied Physics 51 (38), 384002, 2018 | 21 | 2018 |
| The stereo-dynamics of collisional autoionization of ammonia by helium and neon metastable excited atoms through molecular beam experiments S Falcinelli, A Bartocci, S Cavalli, F Pirani, F Vecchiocattivi The Journal of Chemical Physics 143 (16), 2015 | 21 | 2015 |
| Interaction of O2 with CH4, CF4, and CCl4 by Molecular Beam Scattering Experiments and Theoretical Calculations D Cappelletti, V Aquilanti, A Bartocci, F Nunzi, F Tarantelli, L Belpassi, ... The Journal of Physical Chemistry A 120 (27), 5197-5207, 2016 | 17 | 2016 |
| Intermolecular Interaction in the H2S–H2 Complex: Molecular Beam Scattering Experiments and Ab-Inito Calculations A Bartocci, D Cappelletti, F Pirani, F Tarantelli, L Belpassi The Journal of Physical Chemistry A 118 (33), 6440-6450, 2014 | 14 | 2014 |
| Towards design of drugs and delivery systems with the Martini coarse-grained model LR Kjølbye, GP Pereira, A Bartocci, M Pannuzzo, S Albani, A Marchetto, ... QRB Discovery, 1-51, 2022 | 12 | 2022 |
| Intermolecular potential energy surfaces for the interaction between H2X (XO, S) and a metastable Ne*(3P2, 0) atom S Falcinelli, A Bartocci, P Candori, F Pirani, F Vecchiocattivi Chemical Physics Letters 614, 171-175, 2014 | 11 | 2014 |
| Molecular Dynamics Approach for Capturing Calixarene–Protein Interactions: The Case of Cytochrome C A Bartocci, N Gillet, T Jiang, F Szczepaniak, E Dumont The Journal of Physical Chemistry B 124 (50), 11371-11378, 2020 | 9 | 2020 |
| Capturing the dynamic association between a tris-dipicolinate lanthanide complex and a decapeptide: a combined paramagnetic NMR and molecular dynamics exploration S Denis-Quanquin, A Bartocci, F Szczepaniak, F Riobé, O Maury, ... Physical Chemistry Chemical Physics 23 (19), 11224-11232, 2021 | 8 | 2021 |
| Influence of divalent cations in the protein crystallization process assisted by lanthanide-based additives A Roux, R Talon, Z Alsalman, S Engilberge, A d’Aléo, S Di Pietro, A Robin, ... Inorganic Chemistry 60 (20), 15208-15214, 2021 | 7 | 2021 |
| An ab initio electronic density study of the CH4–Ar, CH4–Xe, CH4–H2O and CH4–H2S complexes: insights into the nature of the intermolecular interaction A Bartocci, F Frati, LF Roncaratti, D Cappelletti, F Tarantelli, L Belpassi, ... Molecular Physics 113 (24), 3992-3999, 2015 | 7 | 2015 |
| Assessing the sequence dependence of pyrimidine–pyrimidone (6–4) photoproduct in a duplex double-stranded DNA: A pitfall for microsecond range simulation N Gillet, A Bartocci, E Dumont The Journal of Chemical Physics 154 (13), 2021 | 5 | 2021 |
| Capturing the Recognition Dynamics of para-Sulfonato-calix[4]arenes by Cytochrome c: Toward a Quantitative Free Energy Assessment A Bartocci, G Pereira, M Cecchini, E Dumont Journal of Chemical Information and Modeling 62, 6739−6748, 2022 | 4 | 2022 |
| Probing the dynamical interaction of the para-sulfonato-calix [4] arene with an antifungal protein A Bartocci, E Dumont Physical Chemistry Chemical Physics 25 (27), 18067-18074, 2023 | 2 | 2023 |
| A millisecond coarse-grained simulation approach to decipher allosteric cannabinoid binding at the glycine receptor α1 A Bartocci, PCT Souza, M Cecchini bioRxiv, 2023.04. 19.537578, 2023 | 1 | 2023 |
Pirani FernandoUniversità di PerugiaVerified email at unipg.it
