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1

Features in chemical kinetics. II. A self-emerging definition of slow manifolds

Nicolini, Paolo, Frezzato, Diego

Journal:

The Journal of Chemical Physics

Year:

2013

Language:

english

File:

PDF, 5.37 MB

english, 2013

2

Stochastic modelling of roto-translational motion of dyes in micellar environment

Diego Frezzato, Antonino Polimeno, Alberta Ferrarini, Giorgio J. Moro

Journal:

Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta)

Year:

2007

Language:

english

File:

PDF, 286 KB

english, 2007

3

Photoexcitation free energies of solvated molecules from raw absorption spectra: Can a Jarzynski-like equality be employed?

Journal:

Chemical Physics Letters

Year:

2012

Language:

english

File:

PDF, 525 KB

english, 2012

4

Toward quantitative estimates of binding affinities for protein-ligand systems involving large inhibitor compounds: A steered molecular dynamics simulation route

Nicolini, Paolo, Frezzato, Diego, Gellini, Cristina, Bizzarri, Marco, Chelli, Riccardo

Journal:

Journal of Computational Chemistry

Year:

2013

Language:

english

File:

PDF, 824 KB

english, 2013

5

Features in chemical kinetics. I. Signatures of self-emerging dimensional reduction from a general format of the evolution law

Nicolini, Paolo, Frezzato, Diego

Journal:

The Journal of Chemical Physics

Year:

2013

Language:

english

File:

PDF, 1.39 MB

english, 2013

6

Transverse nuclear spin relaxation induced by director fluctuations in a nematic liquid crystal polymer. Evaluation of the anisotropic elastic constants

Frezzato, Diego, Moro, Giorgio J., Tittelbach, Markus, Kothe, Gerd

Journal:

The Journal of Chemical Physics

Year:

2003

Language:

english

File:

PDF, 428 KB

english, 2003

7

Dynamics of liquid benzene: A cage analysis

Magro, Andrea, Frezzato, Diego, Polimeno, Antonino, Moro, Giorgio J., Chelli, Riccardo, Righini, Roberto

Journal:

The Journal of Chemical Physics

Year:

2005

Language:

english

File:

PDF, 936 KB

english, 2005

8

Nuclear Spin Relaxation Driven by Intermolecular Dipolar Interactions: The Role of Solute−Solvent Pair Correlations in the Modeling of Spectral Density Functions

Frezzato, Diego, Rastrelli, Federico, Bagno, Alessandro

Journal:

Journal of Physical Chemistry B

Year:

2006

Language:

english

File:

PDF, 210 KB

english, 2006

9

Angular dependence of 2 H-NMR longitudinal spin relaxation in aligned nematic 4-n-pentyl-4'-cyanobiphenyl: molecular rotation and director fluctuations

Cifelli, Mario, Frezzato, Diego, Luckhurst, Geoffrey R., Moro, Giorgio J., Sugimura, Akihiko, Veracini, Carlo A.

Journal:

Liquid Crystals

Year:

2010

Language:

english

File:

PDF, 428 KB

english, 2010

10

Transverse Nuclear Spin Relaxation Due to Director Fluctuations in Liquid Crystals A Slow-Motional Theory

Frezzato, Diego, Kothe, Gerd, Moro, Giorgio J.

Journal:

Journal of Physical Chemistry B

Year:

2001

Language:

english

File:

PDF, 125 KB

english, 2001

11

Collective Fluctuations in Ordered Fluids Investigated by Two-Dimensional Electron−Electron Double Resonance Spectroscopy

Fresch, Barbara, Frezzato, Diego, Moro, Giorgio J., Kothe, Gerd, Freed, Jack H.

Journal:

Journal of Physical Chemistry B

Year:

2006

Language:

english

File:

PDF, 437 KB

english, 2006

12

Director Fluctuations and ESR Spectra: A Slow-Motional Treatment †

Frezzato, Diego, Kothe, Gerd, Moro, Giorgio J.

Journal:

Journal of Physical Chemistry B

Year:

2004

Language:

english

File:

PDF, 166 KB

english, 2004

13

Exploiting Configurational Freezing in Nonequilibrium Monte Carlo Simulations

Nicolini, Paolo, Frezzato, Diego, Chelli, Riccardo

Journal:

Journal of Chemical Theory and Computation

Year:

2011

Language:

english

File:

PDF, 1.68 MB

english, 2011

14

Looking for some free energy? Call JEFREE (…)

Zerbetto, Mirco, Piserchia, Andrea, Frezzato, Diego

Journal:

Journal of Computational Chemistry

Year:

2014

Language:

english

File:

PDF, 787 KB

english, 2014

15

Transverse Nuclear Spin Relaxation in Nematic Liquid Crystals. Angular Dependence of the Relaxation Rate in Pulsed Experiments

Frezzato, Diego, Moro, Giorgio J.

Journal:

Molecular Crystals and Liquid Crystals

Year:

2009

Language:

english

File:

PDF, 378 KB

english, 2009

16

Summation through stochastic drawing of addends under steered morphing

Zerbetto, Mirco, Frezzato, Diego

Journal:

Journal of Computational and Applied Mathematics

Year:

2015

Language:

english

File:

PDF, 485 KB

english, 2015

17

Roto-Translational Diffusion in Smectic-C Liquid Crystals

Frezzato, Diego, Moro, Giorgio J.

Journal:

Molecular Crystals and Liquid Crystals

Year:

2003

Language:

english

File:

PDF, 500 KB

english, 2003

18

Slow Dynamics of Banana-Shaped Molecules: A Theoretical Approach to Analyze 2 H-NMR T 2 Relaxation Times

Domenici, Valentina, Frezzato, Diego, Veracini, Carlo Alberto

Journal:

Journal of Physical Chemistry B

Year:

2006

Language:

english

File:

PDF, 224 KB

english, 2006

19

Transverse Nuclear Spin Relaxation Studies of Viscoelastic Properties of Membrane Vesicles. II. Experimental Results

Althoff, Gerhard, Stauch, Oliver, Vilfan, Marija, Frezzato, Diego, Moro, Giorgio J., Hauser, Philipp, Schubert, Rolf, Kothe, Gerd

Journal:

Journal of Physical Chemistry B

Year:

2002

Language:

english

File:

PDF, 138 KB

english, 2002

20

Transverse Nuclear Spin Relaxation Studies of Viscoelastic Properties of Membrane Vesicles. I. Theory

Althoff, Gerhard, Frezzato, Diego, Vilfan, Marija, Stauch, Oliver, Schubert, Rolf, Vilfan, Igor, Moro, Giorgio J., Kothe, Gerd

Journal:

Journal of Physical Chemistry B

Year:

2002

Language:

english

File:

PDF, 144 KB

english, 2002

21

Transverse Nuclear Spin Relaxation Induced by Shape Fluctuations in Membrane Vesicles. Theory and Experiments

Althoff, Gerhard, Frezzato, Diego, Kothe, Gerd, Frezzato, Diego, Moro, Giorgio J., Vilfan, Marija, Vilfan, Igor, Stauch, Oliver, Schubert, Rolf

Journal:

Molecular Crystals and Liquid Crystals

Year:

2003

Language:

english

File:

PDF, 289 KB

english, 2003

22

Transverse Nuclear Spin Relaxation in Nematic Liquid Crystals. Effect of the Anisotropy of the Viscoelastic Parameters

Frezzato, Diego, Kothe, Gerd, Moro, Giorgio J.

Journal:

Molecular Crystals and Liquid Crystals

Year:

2003

Language:

english

File:

PDF, 181 KB

english, 2003

23

Transverse nuclear spin relaxation due to director fluctuations in liquid crystals. III. A slow-motional theory for the angular dependence in pulsed experiments

Frezzato, Diego, Kothe, Gerd, Moro, Giorgio J.

Journal:

The Journal of Chemical Physics

Year:

2003

Language:

english

File:

PDF, 427 KB

english, 2003

24

Transverse nuclear spin relaxation due to director fluctuations in liquid crystals. II. Second-order contributions of the fluctuating director

Frezzato, Diego, Moro, Giorgio J., Kothe, Gerd

Journal:

The Journal of Chemical Physics

Year:

2003

Language:

english

File:

PDF, 551 KB

english, 2003

25

Molecular diffusion in liquid crystals and chiral discrimination. I. Theory

Frezzato, Diego, Moro, Giorgio J., Zannoni, Claudio

Journal:

The Journal of Chemical Physics

Year:

2005

Language:

english

File:

PDF, 430 KB

english, 2005

26

Multidimensional stochastic models for the study of molecular motions in liquids and liquid crystals

NORDIO, PIER LUIGI, FREZZATO, DIEGO, POLIMENO, ANTONINO

Journal:

Molecular Physics

Year:

1999

Language:

english

File:

PDF, 1.27 MB

english, 1999

27

Deuterium NMR Evidences of Slow Dynamics in the Nematic Phase of a Banana-Shaped Liquid Crystal

Domenici, Valentina, Fodor-Csorba, Katalin, Frezzato, Diego, Moro, Giorgio, Veracini, Carlo Alberto

Journal:

Year:

2006

Language:

english

File:

PDF, 702 KB

english, 2006

28

Probing the conformational energetics of alkyl thiols on gold surfaces by means of a morphing/steering non-equilibrium tool

Piserchia, Andrea, Zerbetto, Mirco, Frezzato, Diego

Journal:

Physical Chemistry Chemical Physics

Year:

2015

Language:

english

File:

PDF, 5.13 MB

english, 2015

29

MD simulation of xenon in ionic liquids: Disentangling the cationic and anionic cage effects on the structural and dynamic properties

Frezzato, Diego, Bagno, Alessandro, Castiglione, Franca, Mele, Andrea, Saielli, Giacomo

Journal:

Journal of Molecular Liquids

Year:

2015

Language:

english

File:

PDF, 867 KB

english, 2015

30

Towards bulk thermodynamics via non-equilibrium methods: gaseous methane as a case study

Zerbetto, Mirco, Frezzato, Diego

Journal:

Physical Chemistry Chemical Physics

Year:

2015

Language:

english

File:

PDF, 2.24 MB

english, 2015

31

Multidimensional integration through Markovian sampling under steered function morphing: A physical guise from statistical mechanics

Zerbetto, Mirco, Frezzato, Diego

Journal:

Computer Physics Communications

Year:

2015

Language:

english

File:

PDF, 543 KB

english, 2015

32

Local biaxiality in cholesteric liquid crystals from the surface interaction model

Frezzato, Diego, Moro, Giorgio J.

Journal:

The Journal of Chemical Physics

Year:

2008

Language:

english

File:

PDF, 357 KB

english, 2008

33

Molecular diffusion in liquid crystals and chiral discrimination. II. Model calculations

Frezzato, Diego, Zannoni, Claudio, Moro, Giorgio J.

Journal:

The Journal of Chemical Physics

Year:

2006

Language:

english

File:

PDF, 675 KB

english, 2006

34

Conformational Mobility in Monolayer-Protected Nanoparticles: From Torsional Free Energy Profiles to NMR Relaxation

Piserchia, Andrea, Zerbetto, Mirco, Salvia, Marie-Virginie, Salassa, Giovanni, Gabrielli, Luca, Mancin, Fabrizio, Rastrelli, Federico, Frezzato, Diego

Journal:

The Journal of Physical Chemistry C

Year:

2015

Language:

english

File:

PDF, 2.96 MB

english, 2015

35

A STOCHASTIC CAGE MODEL FOR THE ORIENTATIONAL DYNAMICS OF SINGLE MOLECULES IN NEMATIC PHASES

FREZZATO, DIEGO, SAIELLI, GIACOMO, POLIMENO, ANTONINO, NORDIO, PIER LUIGI

Journal:

International Journal of Modern Physics C

Year:

1999

Language:

english

File:

PDF, 431 KB

english, 1999

36

Distribution and Dynamic Properties of Xenon Dissolved in the Ionic Smectic Phase of [C 16 mim][NO 3 ]: MD Simulation and Theoretical Model

Frezzato, Diego, Saielli, Giacomo

Journal:

Journal of Physical Chemistry B

Year:

2016

Language:

english

File:

PDF, 2.11 MB

english, 2016

37

Loop electrostatics asymmetry modulates the pre-existing conformational equilibrium in thrombin

Pozzi, Nicola, Zerbetto, Mirco, Acquasaliente, Laura, Tescari, Simone, Frezzato, Diego, Polimeno, Antonino, Gohara, David W, Di Cera, Enrico, De Filippis, Vincenzo

Journal:

Year:

2016

Language:

english

File:

PDF, 1.83 MB

english, 2016

38

Fluctuating systems under cyclic perturbations: Relation between energy dissipation and intrinsic relaxation processes

Camerin, Fabrizio, Frezzato, Diego

Journal:

Physical Review E

Year:

2016

Language:

english

File:

PDF, 2.34 MB

english, 2016

39

A Low-Computational-Cost Strategy to Localize Points in the Slow Manifold Proximity for Isothermal Chemical Kinetics

Ceccato, Alessandro, Nicolini, Paolo, Frezzato, Diego

Journal:

International Journal of Chemical Kinetics

Year:

2017

Language:

english

File:

PDF, 888 KB

english, 2017

40

Features in chemical kinetics. III. Attracting subspaces in a hyper-spherical representation of the reactive system

Ceccato, Alessandro, Nicolini, Paolo, Frezzato, Diego

Journal:

The Journal of Chemical Physics

Year:

2015

Language:

english

File:

PDF, 2.81 MB

english, 2015

41

Ion Pair Formation between Tertiary Aliphatic Amines and Perchlorate in the Biphasic Water/Dichloromethane System

Badocco, Denis, Di Marco, Valerio, Venzo, Alfonso, Frasconi, Marco, Frezzato, Diego, Pastore, Paolo

Journal:

Journal of Physical Chemistry B

Year:

2017

Language:

english

File:

PDF, 728 KB

english, 2017

42

Dissipation, lag, and drift in driven fluctuating systems

Frezzato, Diego

Journal:

Physical Review E

Year:

2017

Language:

english

File:

PDF, 1.24 MB

english, 2017

43

Remarks on the chemical Fokker-Planck and Langevin equations: Nonphysical currents at equilibrium

Ceccato, Alessandro, Frezzato, Diego

Journal:

The Journal of Chemical Physics

Year:

2018

Language:

english

File:

PDF, 1.34 MB

english, 2018

44

Tagged-moiety viewpoint of chemical reaction networks

Sabatino, Andrea, Frezzato, Diego

Journal:

The Journal of Chemical Physics

Year:

2019

File:

PDF, 1.74 MB

2019

45

Tagged-moiety viewpoint of chemical reaction networks

Sabatino, Andrea, Frezzato, Diego

Journal:

The Journal of Chemical Physics

Year:

2019

Language:

english

File:

PDF, 1.74 MB

english, 2019

46

Inequalities for overdamped fluctuating systems

Ceccato, Alessandro, Frezzato, Diego

Journal:

Journal of Mathematical Chemistry

Year:

2019

Language:

english

File:

PDF, 796 KB

english, 2019

47

Individual-molecule perspective analysis of chemical reaction networks: the case of a light-driven supramolecular pump

Sabatino, Andrea, Penocchio, Emanuele, Ragazzon, Giulio, Credi, Alberto, Frezzato, Diego

Journal:

Angewandte Chemie International Edition

Year:

2019

Language:

english

File:

PDF, 1.29 MB

english, 2019

48

Chromatographic NMR spectroscopy: the effect of hollow silica microspheres on magnetic field inhomogeneities and resonance lineshapes

De Biasi, Federico, Moro, Federico, Frezzato, Diego, Rastrelli, Federico

Journal:

Physical Chemistry Chemical Physics

Year:

2020

File:

PDF, 2.17 MB

2020

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