Developing and Validating a Set of All-Atom Potential Models for Sodium Dodecyl Sulfate
Author:
Affiliation:
1. Department of Physical Chemistry, V.N. Karazin Kharkiv National University, Svobody sq. 4, Kharkiv 61022, Ukraine
Funder
Ministry of Education and Science of Ukraine
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry,Computer Science Applications
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.7b00181
Reference43 articles.
1. Multiscale molecular dynamics simulations of sodium dodecyl sulfate micelles: from coarse-grained to all-atom resolution
2. Complementary Use of Simulations and Molecular-Thermodynamic Theory to Model Micellization
3. Effect of Ca2+ and Mg2+ Ions on Surfactant Solutions Investigated by Molecular Dynamics Simulation
4. Molecular Dynamics Simulation of Sodium Dodecyl Sulfate Micelle in Water: Micellar Structural Characteristics and Counterion Distribution
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