List of works - Vagelis Harmandaris

A methodology for determining the local mechanical properties of model atomistic glassy polymeric nanostructured materials

scientific article published in 2022

A novel method for measuring the bending rigidity of model lipid membranes by simulating tethers

scientific article published on 01 November 2006

Aggregation and vesiculation of membrane proteins by curvature-mediated interactions

scientific article published in Nature

Atomistic molecular dynamics simulation of the temperature and pressure dependences of local and terminal relaxations in cis-1,4-polybutadiene

scientific article published in February 2006

Backmapping coarse-grained macromolecules: An efficient and versatile machine learning approach

scientific article published on 01 July 2020

Coarse-graining of polyisoprene melts using inverse Monte Carlo and local density potentials

scientific article published on 01 March 2020

Dynamic heterogeneity in fully miscible blends of polystyrene with oligostyrene

scientific article

Dynamics and Structure of Monolayer Polymer Crystallites on Graphene

scientific article published on 27 October 2016

Dynamics of various polymer-graphene interfacial systems through atomistic molecular dynamics simulations

scientific article published in April 2014

Effect of macromolecular architecture on the self-assembly behavior of copolymers in a selective polymer host

scientific article published on 01 December 2018

Effect of solvent on the self-assembly of dialanine and diphenylalanine peptides

scientific article published on 5 April 2013

FROM ATOMISTIC TO SYSTEMATIC COARSE-GRAINED MODELS FOR MOLECULAR SYSTEMS

Fluorescence Correlation Spectroscopy Study of Molecular Probe Diffusion in Polymer Melts

scientific article published on 14 July 2009

Hierarchical modelling of polystyrene melts: from soft blobs to atomistic resolution

scientific article published on 01 January 2019

Investigation of the properties of nanographene in polymer nanocomposites through molecular simulations: dynamics and anisotropic Brownian motion

scientific article published on 01 November 2019

Molecular dynamics of polyisoprene/polystyrene oligomer blends: the role of self-concentration and fluctuations on blend dynamics

scientific article published in July 2013

Multiscale modeling of soft matter: scaling of dynamics

scientific article published on 05 April 2011

Nanostructuring Single-Molecule Polymeric Nanoparticles via Macromolecular Architecture

scientific article published on 15 February 2019

Parametric sensitivity analysis for stochastic molecular systems using information theoretic metrics

scientific article published in July 2015

Path-space variational inference for non-equilibrium coarse-grained systems ⬇️

Rheological and structural studies of linear polyethylene melts under planar elongational flow using nonequilibrium molecular dynamics simulations.