Pubblicazioni

Single-Nucleotide polymorphism of PPARÎ³, a protein at the crossroads of physiological and pathological processes

2017 - INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES

Petrosino, Maria; Lori, Laura; Pasquo, Alessandra; Lori, Clorinda; Consalvi, Valerio; Minicozzi, Velia; Morante, Silvia; Laghezza, Antonio; Giorgi, Alessandra; Capelli, Davide; Chiaraluce, Roberta

Self-assembling of calcium salt of the new DNA base 5-carboxylcytosine

2017 - APPLIED SURFACE SCIENCE

Irrera, Simona; Ruiz Hernandez, Sergio E.; Reggente, Melania; Passeri, Daniele; Natali, Marco; Gala, Fabrizio; Zollo, Giuseppe; Rossi, Marco; Portalone, Gustavo

Thermal compaction of the intrinsically disordered protein tau: entropic, structural, and hydrophobic factors

2017 - PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Battisti, Anna; Ciasca, Gabriele; Grottesi, Alessandro; Tenenbaum, Alexander

Geometrical characterization of an electropore from water positional fluctuations

2017 - THE JOURNAL OF MEMBRANE BIOLOGY

Marracino, Paolo; Castellani, F.; Vernier, P. T.; Liberti, Micaela; Apollonio, Francesca

Diversity of monopolar and bipolar nanosecond pulsed electric signals on the metallo-enzyme superoxide dismutase (SOD), a modelling approach

2017 - Proceedings of the European Conference on Antennas and Propagation

DELLA VALLE, ELENA; MARRACINO, PAOLO; Pakhomova, Olga; LIBERTI, Micaela; APOLLONIO, Francesca

The opposite effect of water and N-methyl-2-pyrrolidone cosolvents on the nanostructural organization of ethylammoniumbutanoate ionic liquid: a small and wide angle X-ray scattering and molecular dynamics simulations study

2017 - JOURNAL OF PHYSICAL CHEMISTRY. B, CONDENSED MATTER, MATERIALS, SURFACES, INTERFACES & BIOPHYSICAL

Salma, Umme; Plechkova, Natalia V; CAMINITI, Ruggero; GONTRANI, Lorenzo

A statistical analytical model for hydrophilic electropore characterization. A comparison study

2017 - RSC ADVANCES

Marracino, Paolo; Liberti, Micaela; Vernier, P. T.; Apollonio, Francesca

Molecular dynamics recipes for genome research

2017 - BRIEFINGS IN BIOINFORMATICS

Biagini, Tommaso; Chillemi, Giovanni; Mazzoccoli, Gianluigi; Grottesi, Alessandro; Fusilli, Caterina; Capocefalo, Daniele; Castellana, Stefano; Vescovi, Angelo Luigi; Mazza, Tommaso

Structure of water in Zn2+ aqueous solutions from ambient conditions up to the gigapascal pressure range: A XANES and molecular dynamics study

2017 - INORGANIC CHEMISTRY

Migliorati, Valentina; Filipponi, Adriano; Di Cicco, Andrea; De Panfilis, Simone; D'Angelo, Paola

Lipid electropore geometry in molecular models

2017 - Handbook of Electroporation

Marracino, Paolo; Vernier, P. Thomas; Liberti, M.; Apollonio, F.

Structure and dynamics of mesophilic variants from the homing endonuclease I-DmoI

2017 - JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN

Alba, Josephine; Marcaida, Maria Jose; Prieto, Jesus; Montoya, Guillermo; Molina, Rafael; DâAbramo, Marco

In Silico Synthesis of Microgel Particles

2017 - MACROMOLECULES

Gnan, Nicoletta; Rovigatti, Lorenzo; Bergman, Maxime; Zaccarelli, Emanuela

Reducing the stochasticity of crystal nucleation to enable subnanosecond memory writing

2017 - SCIENCE

Rao, F.; Ding, K.; Zhou, Y.; Zheng, Y.; Xia, M.; Lv, S.; Song, Z.; Feng, S.; Ronneberger, I.; Mazzarello, R.; Zhang, W.; Ma, E.

Experimental and ab initio molecular dynamics study of the structure and physical properties of liquid GeTe

2017 - PHYSICAL REVIEW. B

Weber, H.; Schumacher, M.; Jovari, P.; Tsuchiya, Y.; Skrotzki, W.; Mazzarello, R.; Kaban, I.

How Does CeIII Nitrate Dissolve in a Protic Ionic Liquid? A Combined Molecular Dynamics and EXAFS Study

2017 - CHEMISTRY-A EUROPEAN JOURNAL

Serva, Alessandra; Migliorati, Valentina; Spezia, Riccardo; D'Angelo, Paola

Intrusion and extrusion of water in hydrophobic nanopores

2017 - PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Tinti, Antonio; Giacomello, Alberto; Grosu, Yaroslav; Casciola, Carlo Massimo

On the selectivity of the NaChBac channel: an integrated computational and experimental analysis of sodium and calcium permeation

2017 - PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Guardiani, Carlo; Fedorenko, Olena A.; Roberts, Stephen K.; Khovanov, Igor A.

Sodium binding sites and permeation mechanism in the NaChBac channel: a molecular dynamics study

2017 - JOURNAL OF CHEMICAL THEORY AND COMPUTATION

Guardiani, Carlo; Mark Rodger, P.; Fedorenko, Olena A.; Roberts, Stephen K.; Khovanov, Igor A.