List of works - Antonio De Nicola

Aggregation of Lipid A Variants: A Hybrid Particle-Field Model

scientific article published on 24 February 2020

Biomembrane solubilization mechanism by Triton X-100: a computational study of the three stage model

scientific article published on 28 September 2017

Effect of Trapped Solvent on the Interface between PS-b-PMMA Thin Films and P(S-r-MMA) Brush Layers

scientific article published on 30 January 2020

Efficient Hybrid Particle-Field Coarse-Grained Model of Polymer Filler Interactions: Multiscale Hierarchical Structure of Carbon Black Particles in Contact with Polyethylene

scientific article published on 13 February 2021

Generation of Well-Relaxed All-Atom Models of Large Molecular Weight Polymer Melts: A Hybrid Particle-Continuum Approach Based on Particle-Field Molecular Dynamics Simulations.

scientific article published on 7 November 2014

Hybrid Particle-Field Coarse-Grained Models for Biological Phospholipids

article

Hybrid Particle-Field Molecular Dynamics Simulations of Charged Amphiphiles in an Aqueous Environment

scientific article published on 07 August 2018

Hybrid particle-field molecular dynamics simulations: parallelization and benchmarks.

scientific article published on 25 January 2012

Hybrid particle-field molecular dynamics under constant pressure

scientific article published on 01 May 2020

Local Structure and Dynamics of Water Absorbed in Poly(ether imide): A Hydrogen Bonding Anatomy.

scientific article published on 23 March 2017

MARTINI Coarse-Grained Model of Triton TX-100 in Pure DPPC Monolayer and Bilayer Interfaces

scientific article published on 14 April 2016

Micellar drug nanocarriers and biomembranes: how do they interact?

scientific article published on 01 March 2014

Micellization of Pluronic P123 in Water/Ethanol/Turpentine Oil Mixed Solvents: Hybrid Particle-Field Molecular Dynamic Simulation

scientific article published on 03 November 2019

Molecular structure and multi-body potential of mean force in silica-polystyrene nanocomposites

scientific article published on 01 November 2018

Nanoparticles at Biomimetic Interfaces: Combined Experimental and Simulation Study on Charged Gold Nanoparticles/Lipid Bilayer Interfaces

scientific article published on 24 December 2018

Self-assembly of carbon nanotubes in polymer melts: simulation of structural and electrical behaviour by hybrid particle-field molecular dynamics

scientific article

Self-assembly of triton X-100 in water solutions: a multiscale simulation study linking mesoscale to atomistic models.

scientific article published on 28 August 2015

Understanding the Interaction of Block Copolymers with DMPC Lipid Bilayer Using Coarse-Grained Molecular Dynamics Simulations