Zeta Potential Prediction from Protein Structure in General Aqueous Electrolyte Solutions

• Published in: Langmuir Vol. 36; no. 46; pp. 13799 - 13803
• Main Authors: Grisham, Daniel R, Nanda, Vikas
• Format: Journal Article
• Language: English
• Published: American Chemical Society 24.11.2020

The ζ, or electrokinetic, potential is the effective charge energy of a molecule in a solution, defining its electrostatic interactions in the solution. A computational protocol for computing ζ potential from the high-resolution structures of proteins (ZPRED) is described. This model considers both...