ELBA water model: Difference between revisions
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Carl McBride (talk | contribs) (Created page with "{{Stub-water}} The '''ELBA''' ('''el'''ectrostatics-'''ba'''sed) model <ref>[http://dx.doi.org/10.1371/journal.pone.0028637 Mario Orsi and Jonathan W. Essex "The ELBA Force Fi...") |
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The '''ELBA''' ('''el'''ectrostatics-'''ba'''sed) model <ref>[http://dx.doi.org/10.1371/journal.pone.0028637 Mario Orsi and Jonathan W. Essex "The ELBA Force Field for Coarse-Grain Modeling of Lipid Membranes", PLoS ONE '''6''' e28637 (2011)]</ref> is a [[Coarse graining|coarse-grained]] model of [[water]], consisting of a single spherical site embedded with a [[Dipole moment|point dipole]]. | The '''ELBA''' ('''el'''ectrostatics-'''ba'''sed) model <ref>[http://dx.doi.org/10.1371/journal.pone.0028637 Mario Orsi and Jonathan W. Essex "The ELBA Force Field for Coarse-Grain Modeling of Lipid Membranes", PLoS ONE '''6''' e28637 (2011)]</ref> is a [[Coarse graining|coarse-grained]] model of [[water]], consisting of a single spherical site, consisting of a [[Lennard-Jones model#Cutoff Lennard-Jones potential|cutoff Lennard-Jones potential]], embedded with a [[Dipole moment|point dipole]]. | ||
==References== | ==References== | ||
<references/> | <references/> | ||
Latest revision as of 13:32, 17 June 2014
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The ELBA (electrostatics-based) model [1] is a coarse-grained model of water, consisting of a single spherical site, consisting of a cutoff Lennard-Jones potential, embedded with a point dipole.
References[edit]
- Related reading
- Mario Orsi and Jonathan W. Essex "Physical properties of mixed bilayers containing lamellar and nonlamellar lipids: insights from coarse-grain molecular dynamics simulations", Faraday Discussions 161 pp. 249-272 (2013)
- Mario Orsi "Comparative assessment of the ELBA coarse-grained model for water", Molecular Physics 112 pp. 1566-1576 (2014)