Literature DB >> 21974511

Monte Carlo and event-driven dynamics of Brownian particles with orientational degrees of freedom.

Flavio Romano1, Cristiano De Michele, Davide Marenduzzo, Eduardo Sanz.   

Abstract

Recently, a simple scaling argument was introduced that allows us to map, with some precautions, Brownian and Monte Carlo dynamics for spherical particles. Here, we extend the scaling to study systems that have orientational degrees of freedom and carefully asses its validity over a wide region of temperature and density. Our work allows us to devise a Brownian Monte Carlo algorithm that produces, to a good approximation, physically meaningful trajectories with a minimum programming effort, although at the expense of some sampling efficiency.
© 2011 American Institute of Physics

Mesh:

Year:  2011        PMID: 21974511     DOI: 10.1063/1.3629452

Source DB:  PubMed          Journal:  J Chem Phys        ISSN: 0021-9606            Impact factor:   3.488


  3 in total

1.  Rotational diffusion affects the dynamical self-assembly pathways of patchy particles.

Authors:  Arthur C Newton; Jan Groenewold; Willem K Kegel; Peter G Bolhuis
Journal:  Proc Natl Acad Sci U S A       Date:  2015-11-30       Impact factor: 11.205

2.  The role of multivalency in the association kinetics of patchy particle complexes.

Authors:  Arthur C Newton; Jan Groenewold; Willem K Kegel; Peter G Bolhuis
Journal:  J Chem Phys       Date:  2017-06-21       Impact factor: 3.488

3.  Simulation and Theory of Antibody Binding to Crowded Antigen-Covered Surfaces.

Authors:  Cristiano De Michele; Paolo De Los Rios; Giuseppe Foffi; Francesco Piazza
Journal:  PLoS Comput Biol       Date:  2016-03-11       Impact factor: 4.475

  3 in total

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