Risultati ricerca pubblicazioni

Modeling Epac1 interactions with the allosteric inhibitor AM-001 by co-solvent molecular dynamics

pubblicato su: JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN - 2020
Bufano M., Laudette M., Blondeau J. -P., Lezoualc'h F., Nalli M., Silvestri R., Brancale A., Coluccia A.

Ab initio molecular dynamics study of phospho-amino acid-based ionic liquids: formation of zwitterionic anions in the presence of acidic side chains

pubblicato su: JOURNAL OF PHYSICAL CHEMISTRY. B, CONDENSED MATTER, MATERIALS, SURFACES, INTERFACES & BIOPHYSICAL - 2020
Adenusi Henry, Le Donne Andrea, Porcelli Francesco, Bodo Enrico

Choline Hydrogen Dicarboxylate Ionic Liquids by X-ray Scattering, Vibrational Spectroscopy and Molecular Dynamics: H-Fumarate and H-Maleate and Their Conformations

pubblicato su: MOLECULES - 2020
Di Muzio Simone, Ramondo Fabio, Gontrani Lorenzo, Ferella Francesco, Nardone Michele, Benassi Paola

Dynamical behavior of the human ferroportin homologue from Bdellovibrio bacteriovorus: Insight into the ligand recognition mechanism

pubblicato su: INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES - 2020
Tortosa V., Bonaccorsi Di Patti M. C., Iacovelli F., Pasquadibisceglie A., Falconi M., Musci G., Polticelli F.

Disclosing the hierarchical structure of ionic liquid mixtures by multiscale computational methods

pubblicato su: Theoretical and Computational Approaches to Predicting Ionic Liquid Properties - 2020
Mariani A., Engelbrecht L., Le Donne A., Mocci F., Bodo E., Passerini S.

The interplay among gas, liquid and solid interactions determines the stability of surface nanobubbles

pubblicato su: NANOSCALE - 2020
Tortora Marco, Meloni Simone, Tan Beng Hau, Giacomello Alberto, Ohl Claus-Dieter, Casciola Carlo Massimo

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