Interaction of Heavy Metals with 7S Soybean Globulin: Molecular Dynamics Study

Molecular dynamics (MD) simulations were performed to examine the structural and dynamic effects of Cd²⁺ and Co³⁺ binding on 7S soybean globulin. Using a 200 ns simulation at 300 K with GROMACS and the CHARMM General Force Field, key structural parameters—including root-mean-square deviation (RMSD),...

Full description

Bibliographic Details
Main Authors: O. Zhytnyakivska, U. Malovytsia, K. Vus, V. Trusova, G. Gorbenko
Format: Article
Language:English
Published: V.N. Karazin Kharkiv National University Publishing 2025-03-01
Series:East European Journal of Physics
Subjects:
Online Access:https://periodicals.karazin.ua/eejp/article/view/25356