Coarse grained free energies with gradient corrections from Monte Carlo simulations in Fourier space

2007 ◽  
Vol 76 (1) ◽  
Author(s):  
A. Tröster
Keyword(s):  
Monte Carlo ◽  
Monte Carlo Simulations ◽  
Coarse Grained ◽  
Fourier Space ◽  
Free Energies ◽  
Gradient Corrections

Coarse Grained End Bridging Monte Carlo Simulations of Poly(ethylene terephthalate) Melt

2007 ◽  
Vol 40 (3) ◽  
pp. 710-722 ◽  
Author(s):  
Kazunori Kamio ◽  
Krzysztof Moorthi ◽  
Doros N. Theodorou
Keyword(s):  
Monte Carlo ◽  
Monte Carlo Simulations ◽  
Ethylene Terephthalate ◽  
Coarse Grained ◽  
Poly Ethylene Terephthalate ◽  
Poly Ethylene

The structure of polymer brushes near the transition from dilute to dense systems. A computer simulation study

Soft Matter ◽  
2021 ◽  
Author(s):  
Piotr Polanowski ◽  
Andrzej Sikorski
Keyword(s):  
Computer Simulation ◽  
Monte Carlo ◽  
Monte Carlo Simulations ◽  
Simulation Study ◽  
Polymer Brushes ◽  
Polymer Brush ◽  
Coarse Grained ◽  
Computer Simulation Study ◽  
Coarse Grained Model ◽  
Cooperative Motion

Monodisperse polymer brushes were studied by means of Monte Carlo simulations. A coarse-grained model of a polymer brush was designed in order and the Cooperative Motion Algorithm was employed to...

Supramolecular assembly of a biomineralizing antimicrobial peptide in coarse-grained Monte Carlo simulations

2011 ◽  
Vol 13 (3) ◽  
pp. 1123-1130 ◽  
Author(s):  
D. Matthew Eby ◽  
Glenn R. Johnson ◽  
Barry L. Farmer ◽  
Ras B. Pandey
Keyword(s):  
Monte Carlo ◽  
Monte Carlo Simulations ◽  
Antimicrobial Peptide ◽  
Supramolecular Assembly ◽  
Coarse Grained

Spatially adaptive lattice coarse-grained Monte Carlo simulations for diffusion of interacting molecules

2004 ◽  
Vol 121 (22) ◽  
pp. 11420 ◽  
Author(s):  
Abhijit Chatterjee ◽  
Dionisios G. Vlachos ◽  
Markos A. Katsoulakis
Keyword(s):  
Monte Carlo ◽  
Monte Carlo Simulations ◽  
Coarse Grained ◽  
Spatially Adaptive
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