Zobrazeno 1 - 10
of 38
pro vyhledávání: '"Jurij Reščič"'
Autor:
Jurij Reščič, Klemen Bohinc
Publikováno v:
Acta Chimica Slovenica, Vol 62, Iss 3, Pp 582-587 (2015)
A coarse-grained model of simple 1:-1 aqueous electrolyte solution in contact with a zwitterionic lipid layer in continuum solvent is studied by canonical Monte Carlo computer simulations and extended Poisson-Boltzmann theory. A structure of zwitteri
Externí odkaz:
https://doaj.org/article/123df116b5f442089fbbd479adb2a203
Publikováno v:
Soft Matter. 19:3640-3651
Correlation between the phase separation of membranes consisting of negatively charged and neutral phospholipids and cation distribution in aqueous solutions is presented.
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::3393beab71f4693a0a456816f80b67a8
https://doi.org/10.1039/d3sm00222e
https://doi.org/10.1039/d3sm00222e
Publikováno v:
Journal of Chemical Theory and Computation
In this study we derived a model for a multicomponent lipid monolayer in contact with an aqueous solution by means of a generalized classical density functional theory and Monte Carlo simulations. Some of the important biological lipid systems were s
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::e6db2952587a11cc8863ac8e8241e862
http://europepmc.org/articles/PMC8757465
http://europepmc.org/articles/PMC8757465
Publikováno v:
Molecular Physics. 117:3695-3702
Thermodynamic perturbation theory for central force associating potential is extended and applied to describe the properties of the valence-limited model of colloidal fluids. The model, which has b...
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::630772eb4f4249dc5a10ec83facb1198
https://doi.org/10.1080/00268976.2019.1662124
https://doi.org/10.1080/00268976.2019.1662124
Publikováno v:
Journal of Molecular Liquids. 228:201-207
Electrolyte solutions often contain globular macroions such as certain proteins, colloids, and lipid vesicles that carry an asymmetric, non-uniform surface charge distribution. For the electrostatic adsorption of these macroions onto an oppositely ch
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::97ead25f1c543747d230010749e39f70
https://doi.org/10.1016/j.molliq.2016.10.087
https://doi.org/10.1016/j.molliq.2016.10.087
The formation of an electric double layer composed of spherical nanoparticles is analyzed by means of a generalized Poisson-Boltzmann model and Monte Carlo simulations. We study a solution of symmetric and asymmetric mixtures of spherical particles t
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::ff970c2514a73fc84a25e41ee6458c69
http://hdl.handle.net/11368/2955704
http://hdl.handle.net/11368/2955704
Publikováno v:
Soft matter. 14(24)
Mixtures of an anionic polyelectrolyte, poly(sodium methacrylate), NaPMA, and a neutral polymer, polyethylene glycol, PEG, were investigated by dynamic and static light scattering techniques at different concentrations and chain-lengths of PEG. The N
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::1cb64cc12d66bd4a8ba6b94b001c5f9f
https://pubmed.ncbi.nlm.nih.gov/29863212
https://pubmed.ncbi.nlm.nih.gov/29863212
Publikováno v:
Soft Matter. 12:4397-4405
The interaction between like-charged objects in electrolyte solutions can be heavily altered by the presence of multivalent ions which possess a spatially distributed charge. In this work, we examine the influence of stiff, multivalent zwitterionic p
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::314e13ca6322a018ab340b84f082fdbe
https://doi.org/10.1039/c6sm00236f
https://doi.org/10.1039/c6sm00236f
Autor:
Klemen Bohinc, Jurij Reščič
Publikováno v:
Acta Chimica Slovenica, Vol 62, Iss 3, Pp 582-587 (2015)
Acta chimica slovenica
Acta chimica slovenica
A coarse-grained model of simple 1:-1 aqueous electrolyte solution in contact with a zwitterionic lipid layer in continuum solvent is studied by canonical Monte Carlo computer simulations and extended Poisson-Boltzmann theory. A structure of zwitteri
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::9c2c870364807cfb36088822482ec890
https://journals.matheo.si/index.php/ACSi/article/view/1561
https://journals.matheo.si/index.php/ACSi/article/view/1561
Autor:
Jurij, Reščič, Per, Linse
Publikováno v:
Journal of Computational Chemistry
The modular software MOLSIM for all‐atom molecular and coarse‐grained simulations is presented with focus on the underlying concepts used. The software possesses four unique features: (1) it is an integrated software for molecular dynamic, Monte
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=pmid________::4556150e69eb3be6c756840f77be8859
http://europepmc.org/articles/PMC5033024
http://europepmc.org/articles/PMC5033024