Coarse-graining of polyisoprene melts using inverse Monte Carlo and local density potentials

Nobahar Shahidi; Antonis Chazirakis; Vagelis Harmandaris; Manolis Doxastakis

doi:10.1063/1.5143245

Coarse-graining of polyisoprene melts using inverse Monte Carlo and local density potentials

The Journal of Chemical Physics ◽

10.1063/1.5143245 ◽

2020 ◽

Vol 152 (12) ◽

pp. 124902 ◽

Cited By ~ 3

Author(s):

Nobahar Shahidi ◽

Antonis Chazirakis ◽

Vagelis Harmandaris ◽

Manolis Doxastakis

Keyword(s):

Monte Carlo ◽

Local Density ◽

Coarse Graining ◽

Inverse Monte Carlo

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On Coarse-Graining by the Inverse Monte Carlo Method: Dissipative Particle Dynamics Simulations Made to a Precise Tool in Soft Matter Modeling

Soft Materials ◽

10.1081/smts-120016746 ◽

2002 ◽

Vol 1 (1) ◽

pp. 121-137 ◽

Cited By ~ 64

Author(s):

Alexander P. Lyubartsev ◽

Mikko Karttunen ◽

Ilpo Vattulainen ◽

Aatto Laaksonen

Keyword(s):

Monte Carlo ◽

Monte Carlo Method ◽

Soft Matter ◽

Dissipative Particle Dynamics ◽

Coarse Graining ◽

Particle Dynamics ◽

Inverse Monte Carlo ◽

Precise Tool ◽

Dynamics Simulations ◽

Inverse Monte Carlo Method

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Systematic hierarchical coarse-graining with the inverse Monte Carlo method

The Journal of Chemical Physics ◽

10.1063/1.4934095 ◽

2015 ◽

Vol 143 (24) ◽

pp. 243120 ◽

Cited By ~ 17

Author(s):

Alexander P. Lyubartsev ◽

Aymeric Naômé ◽

Daniel P. Vercauteren ◽

Aatto Laaksonen

Keyword(s):

Monte Carlo ◽

Monte Carlo Method ◽

Coarse Graining ◽

Inverse Monte Carlo ◽

Inverse Monte Carlo Method

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Temporal coarse-graining of microscopic-lattice kinetic Monte Carlo simulations viaτleaping

Physical Review E ◽

10.1103/physreve.78.046713 ◽

2008 ◽

Vol 78 (4) ◽

Cited By ~ 11

Author(s):

D. G. Vlachos

Keyword(s):

Monte Carlo ◽

Monte Carlo Simulations ◽

Kinetic Monte Carlo ◽

Coarse Graining ◽

Kinetic Monte Carlo Simulations

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Determination of the tumor tissue optical properties during and after photodynamic therapy using inverse Monte Carlo method and double integrating sphere between 350 and 1000 nm

Journal of Biomedical Optics ◽

10.1117/1.3581111 ◽

2011 ◽

Vol 16 (5) ◽

pp. 058003 ◽

Cited By ~ 26

Author(s):

Norihiro Honda ◽

Katsunori Ishii ◽

Takaya Terada ◽

Takuya Nanjo ◽

Kunio Awazu

Keyword(s):

Monte Carlo ◽

Optical Properties ◽

Photodynamic Therapy ◽

Monte Carlo Method ◽

Tumor Tissue ◽

Integrating Sphere ◽

Tissue Optical Properties ◽

Inverse Monte Carlo ◽

Inverse Monte Carlo Method

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The Determination of Atomic Interaction Energies in Solid Solutions from Short Range Order Coefficients — An Inverse Monte Carlo Method

Springer Proceedings in Physics - Atomic Transport and Defects in Metals by Neutron Scattering ◽

10.1007/978-3-642-71007-0_3 ◽

1986 ◽

pp. 17-21 ◽

Cited By ~ 3

Author(s):

V. Gerold ◽

J. Kern

Keyword(s):

Monte Carlo ◽

Monte Carlo Method ◽

Solid Solutions ◽

Short Range ◽

Short Range Order ◽

Atomic Interaction ◽

Interaction Energies ◽

Inverse Monte Carlo ◽

Inverse Monte Carlo Method

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Nematic–smectic-Aphase boundary of ideally oriented Gay-Berne system: Local density functional versus isothermal-isobaric Monte Carlo simulation

Physical Review E ◽

10.1103/physreve.71.032701 ◽

2005 ◽

Vol 71 (3) ◽

Cited By ~ 3

Author(s):

W. Józefowicz ◽

G. Cholewiak ◽

L. Longa

Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Density Functional ◽

Local Density ◽

Functional Versus ◽

Local Density Functional

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Optical properties of tumor tissues grown on the chorioallantoic membrane of chicken eggs measured with a double integrating sphere and inverse Monte Carlo method in the wavelength range of 350–1000 nm

10.1117/12.2002938 ◽

2013 ◽

Cited By ~ 3

Author(s):

Norihiro Honda ◽

Yoichiro Kariyama ◽

Takuya Ishii ◽

Chiaki Abe ◽

Katsushi Inoue ◽

...

Keyword(s):

Monte Carlo ◽

Optical Properties ◽

Monte Carlo Method ◽

Wavelength Range ◽

Chorioallantoic Membrane ◽

Integrating Sphere ◽

Inverse Monte Carlo ◽

Tumor Tissues ◽

Chicken Eggs ◽

Inverse Monte Carlo Method

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Assessment of individual bruising dynamics by pulsed photothermal radiometry and inverse Monte Carlo analysis

10.1117/12.2286118 ◽

2017 ◽

Cited By ~ 2

Author(s):

Ana Marin ◽

Nina Verdel ◽

Luka Vidovič ◽

Matija Milanič ◽

Boris Majaron

Keyword(s):

Monte Carlo ◽

Monte Carlo Analysis ◽

Photothermal Radiometry ◽

Inverse Monte Carlo ◽

Pulsed Photothermal Radiometry

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The determination of atomic interaction energies in solid solutions from short range order coefficients—an inverse monte-carlo method

Acta Metallurgica ◽

10.1016/0001-6160(87)90246-x ◽

1987 ◽

Vol 35 (2) ◽

pp. 393-399 ◽

Cited By ~ 121

Author(s):

V. Gerold ◽

J. Kern

Keyword(s):

Monte Carlo ◽

Monte Carlo Method ◽

Solid Solutions ◽

Short Range ◽

Short Range Order ◽

Atomic Interaction ◽

Interaction Energies ◽

Inverse Monte Carlo ◽

Inverse Monte Carlo Method

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A Coarse-Grained DNA Model Parameterized from Atomistic Simulations by Inverse Monte Carlo

Polymers ◽

10.3390/polym6061655 ◽

2014 ◽

Vol 6 (6) ◽

pp. 1655-1675 ◽

Cited By ~ 38

Author(s):

Nikolay Korolev ◽

Di Luo ◽

Alexander Lyubartsev ◽

Lars Nordenskiöld

Keyword(s):

Monte Carlo ◽

Coarse Grained ◽

Atomistic Simulations ◽

Inverse Monte Carlo

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