Electrolyte Solution at Zwitterionic Lipid Layer
| Autor: | Klemen Bohinc, Jurij Reščič |
|---|---|
| Jazyk: | angličtina |
| Rok vydání: | 2015 |
| Předmět: |
Physics::Biological Physics
Quantitative Biology::Biomolecules Chemistry Monte Carlo method Thermodynamics Electrolyte Poisson–Boltzmann equation Lipids Solutions Monovalent ions Solvent Condensed Matter::Soft Condensed Matter lcsh:Chemistry Electrolytes lcsh:QD1-999 Computational chemistry Poisson-Boltzmann General Earth and Planetary Sciences zwitterion lipid layer Poisson Distribution Lipid bilayer rod-like ion Monte Carlo Method Monte Carlo simulation General Environmental Science |
| Zdroj: | Acta Chimica Slovenica, Vol 62, Iss 3, Pp 582-587 (2015) Acta chimica slovenica |
| ISSN: | 1580-3155 1318-0207 |
| Popis: | 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 zwitterionic layer as well as concentration profiles of positively and negatively charged monovalent ions were obtained from simulations and compared to theoretical predictions. A relatively good agreement between the Monte Carlo computer simulations and theory was observed. |
| Databáze: | OpenAIRE |
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