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Titolo Data di pubblicazione Autore(i) Rivista Editore
Molecular Perspective on Solutions and Liquid Mixtures from Modelling and Experiment Being printed Engelbrecht, Leon de Villiers; Mocci, Francesca; Wang, Yonglei; Perepelytsya, Sergiy; Vasiliu, Tu...dor; Laaksonen, Aatto Springer
Structural Features of the [C4mim][Cl] Ionic Liquid and Its Mixtures with Water: Insight from a 1H NMR Experimental and QM/MD Study Being printed Lengvinaitė, Dovilė; Kvedaraviciute, Sonata; Bielskutė, Stasė; Klimavicius, Vytautas; Balevicius,... Vytautas; Mocci, Francesca; Laaksonen, Aatto; Aidas, Kęstutis JOURNAL OF PHYSICAL CHEMISTRY. B, CONDENSED MATTER, MATERIALS, SURFACES, INTERFACES & BIOPHYSICAL
Cholinium-Based Ionic Liquids from Hydroxycinnamic Acids as New Promising Bioactive Agents: A Combined Experimental and Theoretical Investigation 2021 Demurtas, Monica; Onnis, Valentina; Zucca, Paolo; Rescigno, Antonio; Lachowicz, Joanna Izabela; D...e Villiers Engelbrecht, Leon; Nieddu, Mariella; Ennas, Guido; Scano, Alessandra; Mocci, Francesca; Cesare Marincola, Flaminia ACS SUSTAINABLE CHEMISTRY & ENGINEERING
Insight into the Molecular Model in Carbon Dots through Experimental and Theoretical Analysis of Citrazinic Acid in Aqueous Solution 2021 Cappai, A.; Melis, C.; Stagi, L.; Ricci, P. C.; Mocci, F.; Carbonaro, C. M. JOURNAL OF PHYSICAL CHEMISTRY. C
Theoretical and Experimental Study of the Excess Thermodynamic Properties of Highly Nonideal Liquid Mixtures of Butanol Isomers + DBE 2021 Engelbrecht, Leon de Villiers; Farris, Riccardo; Vasiliu, Tudor; Demurtas, Monica; Piras, Alessan...dra; Cesare Marincola, Flaminia; Laaksonen, Aatto; Porcedda, Silvia; Mocci, Francesca JOURNAL OF PHYSICAL CHEMISTRY. B, CONDENSED MATTER, MATERIALS, SURFACES, INTERFACES & BIOPHYSICAL
Spectroscopic and in silico studies on the interaction of substituted pyrazolo[1,2-a]benzo[1,2,3,4]tetrazine-3-one derivatives with c-myc g4-dna 2021 Mulliri, S.; Laaksonen, A.; Spanu, P.; Farris, R.; Farci, M.; Mingoia, F.; Roviello, G. N.; Mocci..., F. INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES
Electrochemically driven efficient enzymatic conversion of CO2 to formic acid with artificial cofactors 2021 Zhang, Z.; Vasiliu, T.; Li, F.; Laaksonen, A.; Mocci, F.; Ji, X. JOURNAL OF CO2 UTILIZATION
Formation of citrazinic acid ions and their contribution to optical and magnetic features of carbon nanodots: A combined experimental and computational approach 2021 Mocci, F.; Olla, C.; Cappai, A.; Corpino, R.; Ricci, P. C.; Chiriu, D.; Salis, M.; Carbonaro, C. M. MATERIALS
Ionic liquids for CO2 electrochemical reduction 2021 Li, Fangfang; Mocci, Francesca; Zhang, Xiangping; Ji, Xiaoyan; Laaksonen, Aatto CHINESE JOURNAL OF CHEMICAL ENGINEERING
Microstructural and Dynamical Heterogeneities in Ionic Liquids 2020 Wang, Y. -L.; Li, B.; Sarman, S.; Mocci, F.; Lu, Z. -Y.; Yuan, J.; Laaksonen, A.; Fayer, M. D. CHEMICAL REVIEWS
Novel homogeneous selective electrocatalysts for CO2 reduction: an electrochemical and computational study of cyclopentadienyl-phenylendiamino-cobalt complexes 2020 Melis, Nicola; Mocci, Francesca; Vacca, Annalisa; Pilia, Luca SUSTAINABLE ENERGY & FUELS
On the Emission Properties of Carbon Dots: Reviewing Data and Discussing Models 2019 Carbonaro, Cm; Corpino, R; Salis, M; Mocci, F; Thakkar, Sv; Olla, C; Ricci, Pc C
Multigranular modeling of ionic liquids 2019 Wang, Yong-Lei; Sarman, Sten; Golets, Mikhail; Mocci, Francesca; Lu and Aatto Laaksonen, Zhong-Yuan Rasmus Fehrmann and Catherine Santini
On the Charge-Transfer Excitations in Azobenzene Maleimide Compounds: A Theoretical Study 2019 Isac, Dragos Lucian; Airinei, Anton; Maftei, Dan; Humelnicu, Ionel; Mocci, Francesca; Laaksonen, ...Aatto; Pinteală, Mariana JOURNAL OF PHYSICAL CHEMISTRY. A, MOLECULES, SPECTROSCOPY, KINETICS, ENVIRONMENT, & GENERAL THEORY
Pattern preferences of DNA nucleotide motifs by polyamines putrescine2+, spermidine3+ and spermine4 2019 Perepelytsya, Sergiy; Uličný, Jozef; Laaksonen, Aatto; Mocci, Francesca NUCLEIC ACIDS RESEARCH
195Pt NMR and Molecular Dynamics Simulation Study of the Solvation of [PtCl6]2-in Water-Methanol and Water-Dimethoxyethane Binary Mixtures 2018 Engelbrecht, LEON DE VILLIERS; Mocci, F; Laaksonen, A; Koch, Kr INORGANIC CHEMISTRY
Coarse-Grained Simulation of Rodlike Higher-Order Quadruplex Structures at Different Salt Concentrations 2017 Rebič, Matúš; Mocci, Francesca; Uličný, Jozef; Lyubartsev, Alexander P.; Laaksonen, Aatto ACS OMEGA
Inhomogeneity in ethylammonium nitrate–acetonitrile binary mixtures: The highest “low q excess” reported to date 2017 Mariani, Alessandro; Caminiti, Ruggero; Ramondo, Fabio; Salvitti, Giovanna; Mocci, Francesca; Lor...enzo Gontrani, And THE JOURNAL OF PHYSICAL CHEMISTRY LETTERS
Reducing properties of 1,2-dipyridyl-1,2-disodioethanes: Chemical validation of theoretical and electrochemical predictions 2016 Azzena, U.; Carraro, M.; Pisano, L.; Mocci, F.; Antonello, S.; Maran, F. RSC ADVANCES
BASE SEQUENCE SPECIFICITY OF COUNTERION BINDING TO DNA: WHAT CAN MD SIMULATIONS TELL US? 2016 Atzori, Alessio; Liggi, Sonia; Laaksonen, AATTO ILMARI; Porcu, Massimiliano; Lyubartsev, Alexande...r; Saba, Giuseppe; Mocci, Francesca CANADIAN JOURNAL OF CHEMISTRY

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