Biomolecular simulations under realistic macroscopic salt conditions
G. A. Ross, A. S. Rustenburg, P. B. Grinaway, J. Fass, J. D. Chodera
This paper introduces a Monte Carlo osmostat to simulate biomolecules under dynamic salt conditions, showing significant differences in salt concentration distributions compared to fixed-salt simulations.
bioRxiv · Mar 18, 2018Biophysics