Giuseppe Milano
Giuseppe Milano
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Mapping atomistic simulations to mesoscopic models: A systematic coarse-graining procedure for vinyl polymer chains
G Milano, F MŘller-Plathe
The Journal of Physical Chemistry B 109 (39), 18609-18619, 2005
Coarse-grained and reverse-mapped united-atom simulations of long-chain atactic polystyrene melts: Structure, thermodynamic properties, chain conformation, and entanglements
T Spyriouni, C Tzoumanekas, D Theodorou, F MŘller-Plathe, G Milano
Macromolecules 40 (10), 3876-3885, 2007
GALAMOST: GPU‐accelerated large‐scale molecular simulation toolkit
YL Zhu, H Liu, ZW Li, HJ Qian, G Milano, ZY Lu
Journal of Computational Chemistry 34 (25), 2197-2211, 2013
Shape and volume of cavities in thermoplastic molecular sieves based on syndiotactic polystyrene
G Milano, V Venditto, G Guerra, L Cavallo, P Ciambelli, D Sannino
Chemistry of materials 13 (5), 1506-1511, 2001
Thermoplastic molecular sieves
G Guerra, G Milano, V Venditto, P Musto, C De Rosa, L Cavallo
Chemistry of Materials 12 (2), 363-368, 2000
Hybrid particle-field molecular dynamics simulations for dense polymer systems
G Milano, T Kawakatsu
The Journal of chemical physics 130 (21), 214106, 2009
From mesoscale back to atomistic models: A fast reverse-mapping procedure for vinyl polymer chains
G Santangelo, A Di Matteo, F MŘller-Plathe, G Milano
The Journal of Physical Chemistry B 111 (11), 2765-2773, 2007
Site chirality as a messenger in chain-end stereocontrolled propene polymerization
G Milano, L Cavallo, G Guerra
Journal of the American Chemical Society 124 (45), 13368-13369, 2002
Multicentered Gaussian‐based potentials for coarse‐grained polymer simulations: Linking atomistic and mesoscopic scales
G Milano, S Goudeau, F MŘller‐Plathe
Journal of Polymer Science Part B: Polymer Physics 43 (8), 871-885, 2005
Understanding the interaction of block copolymers with DMPC lipid bilayer using coarse-grained molecular dynamics simulations
S Hezaveh, S Samanta, A De Nicola, G Milano, D Roccatano
The journal of physical chemistry B 116 (49), 14333-14345, 2012
Understanding at molecular level of nanoporous and co-crystalline materials based on syndiotactic polystyrene
G Milano, G Guerra
Progress in materials science 54 (1), 68-88, 2009
Anisotropic diffusion of small penetrants in the δ crystalline phase of syndiotactic polystyrene: a molecular dynamics simulation study
G Milano, G Guerra, F MŘller-Plathe
Chemistry of materials 14 (7), 2977-2982, 2002
Gold nanoparticle/polymer interfaces: All atom structures from molecular dynamics simulations
G Milano, G Santangelo, F Ragone, L Cavallo, A Di Matteo
The Journal of Physical Chemistry C 115 (31), 15154-15163, 2011
Orientation and microenvironment of naphthalene guest in the host nanoporous phase of syndiotactic polystyrene
V Venditto, G Milano, A De Girolamo Del Mauro, G Guerra, J Mochizuki, ...
Macromolecules 38 (9), 3696-3702, 2005
Hybrid particle‐field molecular dynamics simulations: Parallelization and benchmarks
Y Zhao, A De Nicola, T Kawakatsu, G Milano
Journal of Computational Chemistry 33 (8), 868-880, 2012
Anisotropic guest diffusion in the δ crystalline host phase of syndiotactic polystyrene: transport kinetics in films with three different uniplanar orientations of the host phase
V Venditto, A De Girolamo Del Mauro, G Mensitieri, G Milano, P Musto, ...
Chemistry of materials 18 (9), 2205-2210, 2006
Molecular dynamics simulation study of solvent effects on conformation and dynamics of polyethylene oxide and polypropylene oxide chains in water and in common organic solvents
S Hezaveh, S Samanta, G Milano, D Roccatano
The Journal of Chemical Physics 136 (12), 124901, 2012
Hybrid particle-field coarse-grained models for biological phospholipids
A De Nicola, Y Zhao, T Kawakatsu, D Roccatano, G Milano
Journal of Chemical Theory and Computation 7 (9), 2947-2962, 2011
Chlorinated guest orientation and mobility in clathrate structures formed with syndiotactic polystyrene
AR Albunia, S Di Masi, P Rizzo, G Milano, P Musto, G Guerra
Macromolecules 36 (23), 8695-8703, 2003
Stereoselective cyclopropanation by cyclocopolymerization of butadiene
S Pragliola, G Milano, G Guerra, P Longo
Journal of the American Chemical Society 124 (14), 3502-3503, 2002
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