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List of works by Claudio Zannoni

"Reduced" distributed monopole model for the efficient prediction of energy transfer in condensed phases.

scientific article published on 19 January 2008

A Molecular Field Theory for Uniaxial Nematic Liquid Crystals Formed by Non-Cylindrically Symmetric Molecules

A Monte Carlo study of the chiral columnar organizations of dissymmetric discotic mesogens

A Monte Carlo study of the mesophases formed by polar bent-shaped molecules

A chirality index for investigating protein secondary structures and their time evolution.

scientific article published in February 2008

A combined theoretical and experimental approach to determining order parameters of solutes in liquid crystals from 13C NMR data.

scientific article

A computer simulation study of the formation of liquid crystal nanodroplets from a homogeneous solution

A computer simulation study of the influence of a liquid crystal medium on polymerization

A computer simulation study of the ordered phases of some mesogenic fullerene derivatives

A soft-core Gay-Berne model for the simulation of liquid crystals by Hamiltonian replica exchange

article

Abrupt orientational changes for liquid crystals adsorbed on a graphite surface

Alignment of small organic solutes in a nematic solvent: the effect of electrostatic interactions

article

An NMR and molecular dynamics investigation of the avian prion hexarepeat conformational features in solution

article

An atomistic description of the nematic and smectic phases of 4-n-octyl-4' cyanobiphenyl (8CB).

scientific article published in May 2013

Assemblies of perylene diimide derivatives with melamine into luminescent hydrogels

scientific article published on 04 October 2011

Biaxial liquid-crystal elastomers: A lattice model

article

Can multi-biaxial mesogenic mixtures favour biaxial nematics? A computer simulation study

scientific article published on 6 January 2017

Can nematic transitions be predicted by atomistic simulations? A computational study of the odd-even effect

Can off-centre mesogen dipoles extend the biaxial nematic range?

Can the pi-facial selectivity of solvation be predicted by atomistic simulation?

scientific article published in August 2005

Charge dissociation at interfaces between discotic liquid crystals: the surprising role of column mismatch.

scientific article published on 10 February 2014

Communication: molecular dynamics and (1)H NMR of n-hexane in liquid crystals.

scientific article published on July 2015

Computer simulations of biaxial nematics

scientific article published on 27 October 2008

Computer simulations of hard pear-shaped particles

scientific article published on 28 August 2003

Computer simulations of nematic droplets with bipolar boundary conditions

scientific article published on 01 October 1994

Computer simulations of the ordering in a hybrid cylindrical film of nematic liquid crystals

article

Conformational preferences of the full chicken prion protein in solution and its differences with respect to mammals

scientific article

Controlling Surface Defect Valence in Colloids

scientific article published in Physical Review Letters

Core charge distribution and self assembly of columnar phases: the case of triphenylenes and azatriphenylenes

scientific article published on 8 June 2007

Directional energy transfer in columnar liquid crystals: A computer-simulation study

Does supramolecular ordering influence exciton transport in conjugated systems? Insight from atomistic simulations

Doping liquid crystals with nanoparticles. A computer simulation of the effects of nanoparticle shape

Dynamical and field effects in polymer-dispersed liquid crystals: monte carlo simulations of NMR spectra

article

EPR study of the polydomain structure of the twist-bend nematic phase of CB9CB in the bulk

Effect of nanoconfinement on liquid-crystal polymer chains

Effective Shape and Dynamics of Chlorophyllain a Nematic Liquid Crystal

article

Efficient analysis of highly complex nuclear magnetic resonance spectra of flexible solutes in ordered liquids by using molecular dynamics

article

Electronic Polarization in Organic Crystals: A Comparative Study of Induced Dipoles and Intramolecular Charge Redistribution Schemes

scientific article published on November 2014

Energy transfer and orientational dynamics in isotropic and nematic phases. A computer simulation approach

article

Energy transfer in condensed systems The effect of phase organization

Expected and unexpected behavior of the orientational order and dynamics induced by azobenzene solutes in a nematic

article

Exploring the energy landscape of the charge transport levels in organic semiconductors at the molecular scale

scientific article

External field-induced switching in nematic elastomers: a Monte Carlo study

Ferroelectric nematic and smectic liquid crystals from tapered molecules

scientific article published on 16 July 2001

Field response and switching times in biaxial nematics.

scientific article published in January 2008

From idealised to predictive models of liquid crystals

Highly Sensitive, Tunable Chirality Amplification through Space Visualized for Gold Nanorods Capped with Axially Chiral Binaphthyl Derivatives

scientific article published on 21 August 2019

How does the trans-cis photoisomerization of azobenzene take place in organic solvents?

scientific article published in April 2010

Insulin glargine improves glycemic control and health-related quality of life in type 1 diabetes

article

LATTICE SPIN SIMULATIONS OF TOPOLOGICAL DEFECTS IN NEMATIC FILMS WITH HYBRID SURFACE ALIGNMENTS

scientific article published in May 2011

Lipid peroxidation and fluidity of plasma membranes from rat liver and Morris hepatoma 3924A.

scientific article published in April 1984

Memory effects in nematics with quenched disorder.

scientific article published on 17 July 2006

Mesogen polarity effects on biaxial nematics. Centrally located dipoles

scientific article published on 01 November 2013

Modeling Polymer Dielectric/Pentacene Interfaces: On the Role of Electrostatic Energy Disorder on Charge Carrier Mobility

article

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

scientific article published on 01 April 2005

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

scientific article

Molecular dipoles and tilted smectic formation: a Monte Carlo study

Molecular dynamics of anhydrous glycolipid self-assembly in lamellar and hexagonal phases.

scientific article

Molecular organization in freely suspended nano-thick 8CB smectic films. An atomistic simulation.

scientific article

Molecular organization of nematic liquid crystals between concentric cylinders: role of the elastic anisotropy

scientific article published on 17 February 2015

Molecular organizations of conical mesogenic fullerenes

Monte Carlo study of liquid-crystal ordering in the independent-pore model of aerogels

article

Monte Carlo study of the effect of an applied field on the molecular organization of polymer-dispersed liquid-crystal droplets

scientific article published on 01 January 1994

Multidimensional Potential Energy Surfaces Resolved at the RASPT2 Level for Accurate Photoinduced Isomerization Dynamics of Azobenzene

scientific article published on 05 November 2019

Multiscale Modeling of the Electrostatic Impact of Self-Assembled Monolayers used as Gate Dielectric Treatment in Organic Thin-Film Transistors

article

NMR spectra from Monte Carlo simulations of polymer dispersed liquid crystals

article

Nematic liquid crystals in planar and cylindrical hybrid cells: Role of elastic anisotropy on the director deformations

scientific article published in July 2015

Nematics with Quenched Disorder: How Long Will It Take to Heal?

scientific article published in Physical Review Letters

Nematics with Quenched Disorder: Pinning out the Origin of Memory

scientific article published in Physical Review Letters

Nematics with dispersed polymer fibrils: a Monte Carlo study of the external-field-induced switching

Nematics with quenched disorder: what is left when long range order Is disrupted?

scientific article published in July 2000

Nonspontaneous Nematic Induction and other Field Effects in Model Mesogens

article

O2-dependent lipid peroxidation does not affect the molecular order in hepatoma microsomes.

scientific article published in March 1986

On the Defect Structure of Biaxial Nematic Droplets.

scientific article published in February 2018

On the importance of detailed structure in molecular electronics (and why microscopic models cannot see the wood for trees)

Order and conformation of biphenyl in cyanobiphenyl liquid crystals: a combined atomistic molecular dynamics and 1H NMR study

article

Order and dynamics inside H-PDLC nanodroplets: an ESR spin probe study

article

Phase Diagram and Orientational Order in a Biaxial Lattice Model: A Monte Carlo Study

scientific article published in Physical Review Letters

Phase diagram of the uniaxial and biaxial soft-core Gay-Berne model

article

Polymer network-induced ordering in a nematogenic liquid: a Monte Carlo study

Predicting the Conditions for Homeotropic Anchoring of Liquid Crystals at a Soft Surface. 4-n-Pentyl-4'-cyanobiphenyl on Alkylsilane Self-Assembled Monolayers

scientific article published on 13 March 2017

Predicting the anchoring of liquid crystals at a solid surface: 5-cyanobiphenyl on cristobalite and glassy silica surfaces of increasing roughness

article

Prion proteins leading to neurodegeneration.

scientific article published on December 2008

Quinquephenyl: The Simplest Rigid-Rod-Like Nematic Liquid Crystal, or is it? An Atomistic Simulation

article

Reversible water driven chirality inversion in cellulose-based helices isolated from Erodium awns

scientific article published on 14 March 2019

Rotational diffusion of shape switching particles in nematic liquid crystals

scientific article published on 9 December 2016

Simulation of vapor-phase deposition and growth of a pentacene thin film on C60 (001)

scientific article published on 08 September 2011

Simulations of Topological Defects in Nematic Liquid Crystal Films

Structural role of compensatory amino acid replacements in the α-synuclein protein.

scientific article

Structures and transitions in thin hybrid nematic films: a Monte Carlo study

scientific article published on 29 May 2003

Supramolecular organization of functional organic materials in the bulk and at organic/organic interfaces: a modeling and computer simulation approach

article

Surface Supramolecular Organization of a Terbium(III) Double-Decker Complex on Graphite and its Single Molecule Magnet Behavior

scientific article published on 12 April 2011

Temperature dependence of charge mobility in model discotic liquid crystals

scientific article published on 22 February 2012

The Orientational Ordering of Some Non-cylindrically Symmetric Solutes in Nematic Solvents

Theoretical characterization of the structural and hole transport dynamics in liquid-crystalline phthalocyanine stacks.

scientific article published in October 2009

Topological defects in schlieren textures of biaxial and uniaxial nematics

Towards in silico liquid crystals. Realistic transition temperatures and physical properties for n-cyanobiphenyls via molecular dynamics simulations

article

Unveiling the role of histidine and tyrosine residues on the conformation of the avian prion hexarepeat domain

scientific article published on 3 April 2008

Wetting behaviour and contact angles anisotropy of nematic nanodroplets on flat surfaces

scientific article published on 15 December 2015

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