Sfoglia per Autore
Hybrid Particle-Field Coarse-Grained Models for Biological Phospholipids
2011-01-01 DE NICOLA, Antonio; Zhao, Ying; Toshihiro, Kawakatsu; Danilo, Roccatano; Milano, Giuseppe
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
2014-01-01 DE NICOLA, Antonio; Kawakatsu, Toshihiro; Milano, Giuseppe
Spontaneous insertion of carbon nanotube bundles inside biomembranes: A hybrid particle-field coarse-grained molecular dynamics study
2014-01-01 Sarukhanyan, Edita; DE NICOLA, Antonio; Roccatano, Danilo; Kawakatsu, Toshihiro; Milano, Giuseppe
Coarse-grained modelling of triglyceride crystallisation: a molecular insight into tripalmitin tristearin binary mixtures by molecular dynamics simulations
2015-01-01 Pizzirusso, Antonio; Brasiello, Antonio; DE NICOLA, Antonio; Marangoni, Alejandro G; Milano, Giuseppe
Self-Assembly of Triton X-100 in Water Solutions: A Multiscale Simulation Study Linking Mesoscale to Atomistic Models
2015-01-01 DE NICOLA, Antonio; Kawakatsu, Toshihiro; Rosano, Camillo; Celino, Massimo; Rocco, Mattia; Milano, Giuseppe
Rational design of nanoparticle/monomer interfaces: A combined computational and experimental study of in situ polymerization of silica based nanocomposites
2015-01-01 DE NICOLA, Antonio; Avolio, Roberto; DELLA MONICA, Francesco; Gentile, Gennaro; Cocca, Mariacristina; Capacchione, Carmine; Errico, Maria Emanuela; Milano, Giuseppe
Fast relaxation of coarse-grained models of polymer interphases by hybrid particle-field molecular dynamics: Polystyrene-silica nanocomposites as an example
2016-01-01 DE NICOLA, Antonio; Kawakatsu, Toshihiro; Müller Plathe, Florian; Milano, Giuseppe
MARTINI Coarse-Grained Model of Triton TX-100 in Pure DPPC Monolayer and Bilayer Interfaces
2016-01-01 Pizzirusso, Antonio; DE NICOLA, Antonio; Milano, Giuseppe
Self-assembly of carbon nanotubes in polymer melts: simulation of structural and electrical behaviour by hybrid particle-field molecular dynamics
2016-01-01 Zhao, Ying; Byshkin, Maksym; Cong, Yue; Kawakatsu, Toshihiro; Guadagno, Liberata; DE NICOLA, Antonio; Yu, Naisen; Milano, Giuseppe; Dong, Bin
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