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IRIS è il sistema di gestione integrata dei dati della ricerca (persone, progetti, pubblicazioni, attività) adottato dall'Università degli Studi di Cagliari dal mese di luglio 2015.

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TitoloData di pubblicazioneAutore(i)RivistaEditore
Microstructural and Dynamical Heterogeneities in Ionic Liquids2020Wang, 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 complexes2020Melis, Nicola; Mocci, Francesca; Vacca, Annalisa; Pilia, LucaSUSTAINABLE ENERGY & FUELS
On the Charge-Transfer Excitations in Azobenzene Maleimide Compounds: A Theoretical Study2019Isac, Dragos Lucian; Airinei, Anton; Maftei, Dan; Humelnicu, Ionel; Mocci, Francesca; Laaksonen, ...Aatto; Pinteală, MarianaJOURNAL OF PHYSICAL CHEMISTRY. A, MOLECULES, SPECTROSCOPY, KINETICS, ENVIRONMENT, & GENERAL THEORY
Pattern preferences of DNA nucleotide motifs by polyamines putrescine2+, spermidine3+ and spermine42019Perepelytsya, Sergiy; Uličný, Jozef; Laaksonen, Aatto; Mocci, FrancescaNUCLEIC ACIDS RESEARCH
On the Emission Properties of Carbon Dots: Reviewing Data and Discussing Models2019Carbonaro, Cm; Corpino, R; Salis, M; Mocci, F; Thakkar, Sv; Olla, C; Ricci, PcC
195Pt NMR and Molecular Dynamics Simulation Study of the Solvation of [PtCl6]2-in Water-Methanol and Water-Dimethoxyethane Binary Mixtures2018Engelbrecht, LEON DE VILLIERS; Mocci, F; Laaksonen, A; Koch, KrINORGANIC CHEMISTRY
Coarse-Grained Simulation of Rodlike Higher-Order Quadruplex Structures at Different Salt Concentrations2017Rebič, Matúš; Mocci, Francesca; Uličný, Jozef; Lyubartsev, Alexander P.; Laaksonen, AattoACS OMEGA
Inhomogeneity in ethylammonium nitrate–acetonitrile binary mixtures: The highest “low q excess” reported to date2017Mariani, Alessandro; Caminiti, Ruggero; Ramondo, Fabio; Salvitti, Giovanna; Mocci, Francesca; Lor...enzo Gontrani, AndTHE JOURNAL OF PHYSICAL CHEMISTRY LETTERS
BASE SEQUENCE SPECIFICITY OF COUNTERION BINDING TO DNA: WHAT CAN MD SIMULATIONS TELL US?2016Atzori, Alessio; Liggi, Sonia; Laaksonen, AATTO ILMARI; Porcu, Massimiliano; Lyubartsev, Alexande...r; Saba, Giuseppe; Mocci, FrancescaCANADIAN JOURNAL OF CHEMISTRY
Molecular dynamics simulation study of parallel telomeric DNA quadruplexes at different ionic strengths: evaluation of water and ion models2016Rebič, Matúš; Laaksonen, AATTO ILMARI; Šponer, Jiří; Uličný, Jozef; Mocci, FrancescaJOURNAL OF PHYSICAL CHEMISTRY. B, CONDENSED MATTER, MATERIALS, SURFACES, INTERFACES & BIOPHYSICAL
Drying oil detected in mid-third Millennium B.C. Mesopotamian clay artifacts: Raman spectroscopy and DFT simulation study2016Chiriu, Daniele; Ricci, Pier Carlo; Carbonaro, Carlo Maria; Nadali, Davide; Polcaro, Andrea; Mocc...i, FrancescaMICROCHEMICAL JOURNAL
Reducing properties of 1,2-dipyridyl-1,2-disodioethanes: Chemical validation of theoretical and electrochemical predictions2016Azzena, U.; Carraro, M.; Pisano, L.; Mocci, F.; Antonello, S.; Maran, F.RSC ADVANCES
Combining MD simulations and NMR spectroscopy for molecular insight and methodological synergy: the integrated MD-NMR method2015Mocci, Francesca; Laaksonen, AATTO ILMARIRoyal Society of Chemistry
Multiscale simulations of human telomeric G-quadruplex DNA2015Rebic, M.; Mocci, Francesca; Laaksonen, A.; Ulicny, J.JOURNAL OF PHYSICAL CHEMISTRY. B, CONDENSED MATTER, MATERIALS, SURFACES, INTERFACES & BIOPHYSICAL
Rotation dynamics do not determine the unexpected isotropy of methyl radical EPR spectra2015Benetis, N. P.; Dmitriev, Y.; Mocci, Francesca; Laaksonen, A.JOURNAL OF PHYSICAL CHEMISTRY. A, MOLECULES, SPECTROSCOPY, KINETICS, ENVIRONMENT, & GENERAL THEORY
Thermo-physical properties of ammonium-based ionic liquid + N-methyl-2-pyrrolidone mixtures at 298.15K2014Usula M; Matteoli E; Leonelli F; Mocci F; Cesare Marincola F; Gontrani L; Porcedda SFLUID PHASE EQUILIBRIA
NMR, calorimetry, and computational studies of aqueous solutions of N-methyl-2-pyrrolidone2014Usula M; Porcedda S; Mocci F; Gontrani L; Caminiti R; Cesare Marincola FJOURNAL OF PHYSICAL CHEMISTRY. B, CONDENSED MATTER, MATERIALS, SURFACES, INTERFACES & BIOPHYSICAL
The structural organization of N-methyl-2-pyrrolidone + water mixtures: A densitometry, x-ray diffraction, and molecular dynamics study2014Usula M; Mocci F; Cesare Marincola F; Porcedda S; Gontrani L; Caminiti RTHE JOURNAL OF CHEMICAL PHYSICS
CompChem and NMR Probing Ionic Liquids2014Mocci, Francesca; Laaksonen, Aatto; Wang, Yong-Lei; Saba, Giuseppe; Lai, Adolfo; Cesare Marincola..., FlaminiaSOFT AND BIOLOGICAL MATTERSpringer International Publishing Switzerland
Glucose oxidase from Penicillium amagasakiense: Characterization of the transition state of its denaturation from molecular dynamics simulations2014Todde, G.; Hovmoller, S.; Laaksonen, A.; Mocci, FrancescaPROTEINS
   
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