Risultati ricerca pubblicazioni

Experimental study and computational modelling of cruzain cysteine protease inhibition by dipeptidyl nitriles

pubblicato su: PHYSICAL CHEMISTRY CHEMICAL PHYSICS - 2018

Dos Santos Alberto Monteiro, Cianni Lorenzo, De Vita Daniela, Rosini Fabiana, Leitão Andrei, Laughton Charles A, Lameira Jerônimo, Montanari Carlos A

Complexation of halide ions to tyrosine: role of non-covalent interactions evidenced by IRMPD spectroscopy

pubblicato su: PHYSICAL CHEMISTRY CHEMICAL PHYSICS - 2018

Corinti Davide, Gregori Barbara, Guidoni Leonardo, Scuderi Debora, Mcmahon Terry B., Chiavarino Barbara, Fornarini Simonetta, Crestoni Maria Elisa

Real time evolution of unprotected protonated galactosamine probed by IRMPD spectroscopy

pubblicato su: PHYSICAL CHEMISTRY CHEMICAL PHYSICS - 2018

Fraschetti C., Guarcini L., Zazza C., Mannina L., Circi S., Piccirillo S., Chiavarino B., Filippi A.

The dramatic effect of N-methylimidazole on trans axial ligand binding to ferric heme: experiment and theory

pubblicato su: PHYSICAL CHEMISTRY CHEMICAL PHYSICS - 2019

Aarabi Mohammad, Omidyan Reza, Soorkia Satchin, Grégoire Gilles, Broquier Michel, Crestoni Maria-Elisa, de la Lande Aurélien, Soep Benoît, Shafizadeh Niloufar

From ascorbic acid to furan derivatives: the gas phase acid catalyzed degradation of vitamin C

pubblicato su: PHYSICAL CHEMISTRY CHEMICAL PHYSICS - 2018

Cimino Paola, Troiani Anna, Pepi Federico, Garzoli Stefania, Salvitti Chiara, Di Rienzo Brunella, Barone Vincenzo, Ricci Andreina

Controlling ionic conductivity through transprotein electropores in human aquaporin 4: A non-equilibrium molecular-dynamics study

pubblicato su: PHYSICAL CHEMISTRY CHEMICAL PHYSICS - 2019

Bernardi M., Marracino P., Liberti M., Garate J. -A., Burnham C. J., Apollonio F., English N. J.

Unexpected proton mobility in the bulk phase of cholinium-based ionic liquids: New insights from theoretical calculations

pubblicato su: PHYSICAL CHEMISTRY CHEMICAL PHYSICS - 2017

Campetella Marco, Montagna Maria, Gontrani Lorenzo, Scarpellini Eleonora, Bodo Enrico

Block copolymers as bile salt sequestrants: intriguing structures formed in a mixture of an oppositely charged amphiphilic block copolymer and bile salt

pubblicato su: PHYSICAL CHEMISTRY CHEMICAL PHYSICS - 2019

Schillén Karin, Galantini Luciano, Du Guanqun, Del Giudice Alessandra, Alfredsson Viveka, Carnerup Anna M, Pavel Nicolae V, Masci Giancarlo, Nyström Bo

Bile acid derivative-based catanionic mixtures: versatile tools for superficial charge modulation of supramolecular lamellae and nanotubes

pubblicato su: PHYSICAL CHEMISTRY CHEMICAL PHYSICS - 2018

di Gregorio Maria Chiara, Severoni Emilia, Travaglini Leana, Gubitosi Marta, Sennato Simona, Mura Francesco, Redondo-Gómez Carlos, Jover Aida, Pavel Nicolae Viorel, Galantini Luciano

Supramolecular assembly of a thermoresponsive steroidal surfactant with an oppositely charged thermoresponsive block copolymer

pubblicato su: PHYSICAL CHEMISTRY CHEMICAL PHYSICS - 2017

Di Gregorio M. C, Gubitosi Marta, Travaglini Leana, Pavel Nicolae V, Jover A, Meijide F, Vázquez Tato J, Sennato Simona, Schillén K, Tranchini F, De Santis Serena, Masci Giancarlo, Galantini Luciano

An experimental and theoretical investigation of XPS and NEXAFS of 5-halouracils

pubblicato su: PHYSICAL CHEMISTRY CHEMICAL PHYSICS - 2018

Castrovilli M. C., Bolognesi P., Bodo E., Mattioli G., Cartoni A., Avaldi L.

Fragmentation of pure and hydrated clusters of 5Br-uracil by low energy carbon ions: observation of hydrated fragments

pubblicato su: PHYSICAL CHEMISTRY CHEMICAL PHYSICS - 2017

Castrovilli M. C., Markush P., Bolognesi P., Rousseau P., Maclot S., Cartoni A., Delaunay R., Domaracka A., Koä?iå¡ek J., Huber B. A., Avaldi L.

Stabilizing lead halide perovskites with quaternary ammonium cations. The case of tetramethylammonium lead iodide

pubblicato su: PHYSICAL CHEMISTRY CHEMICAL PHYSICS - 2019

Ciccioli A., Panetta R., Luongo A., Brunetti B., Vecchio Ciprioti S., Mele M. L., Latini A.

Unraveling the solvation geometries of the lanthanum(III) bistriflimide salt in ionic liquid/acetonitrile mixtures

pubblicato su: PHYSICAL CHEMISTRY CHEMICAL PHYSICS - 2020

Migliorati V., Lapi A., D'Angelo P.

Solvation of Zn 2+ ion in 1-alkyl-3-methylimidazolium bis(trifluoromethylsulfonyl)imide ionic liquids: A molecular dynamics and X-ray absorption study

pubblicato su: PHYSICAL CHEMISTRY CHEMICAL PHYSICS - 2019

Busato M., D'Angelo P., Melchior A.

Solvation structure of lanthanide(iii) bistriflimide salts in acetonitrile solution: A molecular dynamics simulation and EXAFS investigation

pubblicato su: PHYSICAL CHEMISTRY CHEMICAL PHYSICS - 2019

Migliorati V., Filipponi Alessandro, Sessa F., Lapi A., Serva A., D'Angelo P.

On the coordination of Zn2+ion in Tf2N-based ionic liquids: Structural and dynamic properties depending on the nature of the organic cation

pubblicato su: PHYSICAL CHEMISTRY CHEMICAL PHYSICS - 2018

Sessa Francesco, Migliorati Valentina, Serva Alessandra, Lapi Andrea, Aquilanti Giuliana, Mancini Giordano, D'Angelo Paola

The canonical behavior of the entropic component of thermodynamic effective molarity. An attempt at unifying covalent and noncovalent cyclizations

pubblicato su: PHYSICAL CHEMISTRY CHEMICAL PHYSICS - 2019

DI STEFANO Stefano, Mandolini Luigi

X-Ray structure and ionic conductivity studies of anhydrous and hydrated choline chloride and oxalic acid deep eutectic solvents

pubblicato su: PHYSICAL CHEMISTRY CHEMICAL PHYSICS - 2018

Gontrani Lorenzo, Bonomo Matteo, Plechkova Natalia V, Dini Danilo, Caminiti Ruggero

Intriguing transport dynamics of ethylammonium nitrate–acetonitrile binary mixtures arising from nano-inhomogeneity

pubblicato su: PHYSICAL CHEMISTRY CHEMICAL PHYSICS - 2017

Mariani Alessandro, Bonomo Matteo, Wu Boning, Centrella Barbara, Dini Danilo, Castner Edward W. Jr., Gontrani Lorenzo

Coupled hydroxyl and ether functionalisation in EAN derivatives: the effect of hydrogen bond donor/acceptor groups on the structural heterogeneity studied with X-Ray diffractions and fixed charge/polarizable simulations

pubblicato su: PHYSICAL CHEMISTRY CHEMICAL PHYSICS - 2019

Ramondo Fabio, Gontrani Lorenzo, Campetella Marco

X-ray and molecular dynamics studies of butylammonium butanoate-water binary mixtures

pubblicato su: PHYSICAL CHEMISTRY CHEMICAL PHYSICS - 2017

Salma Umme, Usula Marianna, Caminiti Ruggero, Gontrani Lorenzo, Plechkova Natalia V, Seddon Kenneth R.

Water and hexane in an ionic liquid: computational evidence of association under high pressure

pubblicato su: PHYSICAL CHEMISTRY CHEMICAL PHYSICS - 2017

Mariani Alessandro, Caminiti Ruggero, Gontrani Lorenzo

Electronic structure modifications induced by increased molecular complexity: from triphenylamine to m-MTDATA

pubblicato su: PHYSICAL CHEMISTRY CHEMICAL PHYSICS - 2019

Zhang T., Brumboiu I. E., Lanzilotto V., Grazioli C., Guarnaccio A., Johansson F. O. L., Coreno M., De Simone M., Santagata A., Brena B., Puglia C.

A Ru-Ru pair housed in ruthenium phthalocyanine: the role of a "cage" architecture in the molecule coupling with the Ag(111) surface

pubblicato su: PHYSICAL CHEMISTRY CHEMICAL PHYSICS - 2017

Alippi Paola, Lanzilotto Valeria, Paoletti Anna Maria, Mattioli Giuseppe, Zanotti Gloria, Pennesi Giovanna, Filippone Francesco, Cossaro Albano, Verdini Alberto, Morgante Alberto, Amore Bonapasta Aldo

Structural features of selected protic ionic liquids based on a super-strong base

pubblicato su: PHYSICAL CHEMISTRY CHEMICAL PHYSICS - 2019

Triolo Alessandro, Lo Celso Fabrizio, Ottaviani Carlo, Ji Pengju, Appetecchi Giovanni Battista, Leonelli Francesca, Keeble Dean S, Russina Olga

Cisplatin and transplatin interaction with methionine: bonding motifs assayed by vibrational spectroscopy in the isolated ionic complexes

pubblicato su: PHYSICAL CHEMISTRY CHEMICAL PHYSICS - 2017

Paciotti Roberto, Corinti Davide, De Petris Alberto, Ciavardini Alessandra, Piccirillo Susanna, Coletti Cecilia, Re Nazzareno, Maitre Philippe, Bellina Bruno, Barran Perdita, Chiavarino Barbara, Crestoni Maria Elisa, Fornarini Simonetta

Activation of C-H bonds by a nonheme iron(iv)-oxo complex: Mechanistic evidence through a coupled EDXAS/UV-Vis multivariate analysis

pubblicato su: PHYSICAL CHEMISTRY CHEMICAL PHYSICS - 2021

Tavani Francesco, Capocasa Giorgio, Martini Andrea, Sessa Francesco, Di Stefano Stefano, Lanzalunga Osvaldo, D'Angelo Paola

The effect of ether-functionalisation in ionic liquids analysed by DFT calculation, infrared spectra, and Kamlet-Taft parameters

pubblicato su: PHYSICAL CHEMISTRY CHEMICAL PHYSICS - 2018

Tsurumaki A., Trequattrini F., Palumbo O., Panero S., Paolone A., Navarra M. A.

Mesostructure and physical properties of aqueous mixtures of the ionic liquid 1-ethyl-3-methyl imidazolium octyl sulfate doped with divalent sulfate salts in the liquid and the mesomorphic states

pubblicato su: PHYSICAL CHEMISTRY CHEMICAL PHYSICS - 2018

Cabeza O., Segade L., Domínguez-Pérez M., Rilo E., Ausín D., Martinelli A., Yaghini N., Gollas B., Kriechbaum M., Russina O., Triolo A., López-Lago E., Varela L. M.