Darya L. Gurina

Часть публикаций из профиля, по году от новых к старым. Это не полный список последних работ автора; работы без года — в конце.

• Bridging experiment and molecular dynamics: Mefenamic acid confinement in nanocrystalline cellulose aerogels under scCO2 conditions2026
• A Hybrid ASL–MD Strategy To Explain Propylparaben Solvation and Solubility in Binary Acetone/Carbon Tetrachloride Mixtures: Combining Simulation, Theory, and Experiment2026
• Molecular-scale origin of extreme disjoining pressure in water confined in carbon and silica nanopores2026
• How water reverse micelles solubilize polyphenols: An all-atom simulation perspective2025
• Exploring the relationship between water impurities, electrode charge density, and electric double layer structure and capacitance in carbon micropores2025
• Disjoining pressure of room temperature ionic liquid in charged slit carbon nanopore: Molecular dynamics study2022
• Experimental and computational investigation of polylactic acid/silver‐NP nanocomposite with antimicrobial activity prepared by plasma in liquid2020 · аннотациясвернуть

  Abstract In this study, an underwater impulse discharge initiated in an aqueous suspension of a polylactide acid between silver rods is applied to produce silver nanoparticles (AgNPs) and create a polymer nanocomposite.…

• Molecular Dynamics Simulation of Polyacrylamide Adsorption on Cellulose Nanocrystals2020 · аннотациясвернуть

  Classical molecular dynamics simulations of polyacrylamide (PAM) adsorption on cellulose nanocrystals (CNC) in a vacuum and a water environment are carried out to interpret the mechanism of the polymer interactions with…