Coarse-grained Molecular Dynamics Force Field for Carbon Black Filled Natural Rubber by Energy Renormalization Method

2019 ◽  
Author(s):  
JIWON JUNG ◽  
CHANWOOK PARK ◽  
TAEHOON PARK ◽  
GUNJIN YUN
Keyword(s):  
Molecular Dynamics ◽  
Carbon Black ◽  
Natural Rubber ◽  
Force Field ◽  
Coarse Grained ◽  
Renormalization Method ◽  
Energy Renormalization ◽  
Coarse Grained Molecular Dynamics

scholarly journals Investigation of Protein Folding by Coarse-Grained Molecular Dynamics with the UNRES Force Field

2010 ◽  
Vol 114 (13) ◽  
pp. 4471-4485 ◽  
Author(s):  
Gia G. Maisuradze ◽  
Patrick Senet ◽  
Cezary Czaplewski ◽  
Adam Liwo ◽  
Harold A. Scheraga
Keyword(s):  
Molecular Dynamics ◽  
Protein Folding ◽  
Force Field ◽  
Coarse Grained ◽  
Coarse Grained Molecular Dynamics

scholarly journals Coarse-grained molecular dynamics study of the self-assembly of polyphilic bolaamphiphiles using the SAFT-γ Mie force field

2021 ◽  
Author(s):  
Maziar Fayaz-Torshizi ◽  
Erich A. Müller
Keyword(s):  
Molecular Dynamics ◽  
Liquid Crystals ◽  
Molecular Dynamics Simulation ◽  
Force Field ◽  
Self Assembly ◽  
The Self ◽  
Dynamics Simulation ◽  
Coarse Grained ◽  
Molecular Models ◽  
Coarse Grained Molecular Dynamics

A methodology is outlined to parametrize coarse grained molecular models for the molecular dynamics simulation of liquid crystals.

scholarly journals Martini 3: a general purpose force field for coarse-grained molecular dynamics

2021 ◽  
Author(s):  
Paulo C. T. Souza ◽  
Riccardo Alessandri ◽  
Jonathan Barnoud ◽  
Sebastian Thallmair ◽  
Ignacio Faustino ◽  
...  
Keyword(s):  
Molecular Dynamics ◽  
Force Field ◽  
General Purpose ◽  
Coarse Grained ◽  
Coarse Grained Molecular Dynamics
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