Investigating biomolecules in deep eutectic solvents with molecular dynamics simulations: current state, challenges and future perspectives

JP Bittner, I Smirnova, S Jakobtorweihen - Molecules, 2024 - mdpi.com
Deep eutectic solvents (DESs) have recently gained increased attention for their potential in
biotechnological applications. DESs are binary mixtures often consisting of a hydrogen bond …

Assessing the compatibility of choline-based deep eutectic solvents for the structural stability and activity of cellulase: Enzyme sustain at high temperature

N Yadav, D Chahar, M Bisht, P Venkatesu - International Journal of …, 2023 - Elsevier
As a new generation of 'green solvents' deep eutectic solvents (DESs) represents a
promising alternative to the conventional solvents. Their environmental-benign nature and …

Effect of structural stability of lipase in acetonitrile on its catalytic activity in EGCG esterification reaction: FTIR and MD simulation

S Wang, L Mo, B Wu, C Ma, H Wang - International Journal of Biological …, 2024 - Elsevier
Abstract In this study,(-)-Epigallocatechin-3-O-gallate (EGCG) esterification reaction was
catalyzed by Novozym 435, Lipozyme RM, Lipozyme TLIM, and lipase Amano 30SD in …

Solvation Dynamics and Microheterogeneity in Deep Eutectic Solvents

S Chatterjee, T Chowdhury… - The Journal of Physical …, 2024 - ACS Publications
Deep eutectic solvents have attracted considerable attention due to their unique properties
and their potential to replace conventional solvents in diverse applications, such as …

Deep eutectic solvent as an additive to improve enzymatic hydrolysis of polyethylene terephthalate (PET)

X Zheng, J Feng, Y Lu, R Li, A Cavaco-paulo… - Journal of Polymers and …, 2024 - Springer
Enzymatic hydrolysis of polyethylene terephthalate (PET) for surface modification of
polyester fibers has attracted considerable research attention in recent years. However, the …

Lab-on-a-bead: Polymeric natural deep eutectic solvents as a versatile platform for (bio) sensor design

FJV Gomez, E Vidal, CE Domini, G Zanini… - Journal of Molecular …, 2023 - Elsevier
Natural polymers offer not only low-cost, wide availability, biocompatibility, and
biodegradability but also a rich chemical functionality towards custom modifications and new …

Lysozyme stability in various deep eutectic solvents using molecular dynamics simulations

A Hebbar, P Dey, AK Vatti - Journal of Biomolecular Structure and …, 2024 - Taylor & Francis
The ability of neat deep eutectic solvents (DESs) to influence protein structure and function
has gained considerable interest due to the unstable nature of enzymes or therapeutic …

Deep Eutectic Solvents as Suitable Solvents for Lipase‐Catalyzed Transesterification Reactions

J Noro, J Cabo, DS Freitas, CS Roque… - …, 2023 - Wiley Online Library
In this work, three deep eutectic mixtures (DES 1: choline chloride/urea; DES 2: choline
chloride/glycerol; and DES 3: tetrabutylammonium bromide/imidazole) were investigated as …

Ultrasonic‐assisted and enzymatic‐assisted extraction to recover tannins, flavonoids, and terpenoids from used tea leaves using natural deep eutectic solvents

TP Vo, TQD Tran, TH Phan, HD Huynh… - … Journal of Food …, 2023 - Wiley Online Library
The conventional extraction technique using organic solvent was employed to recover
bioactive compounds from plants; however, this technique showed low efficiency and …

The multiple enhancements of deep eutectic solvent on cellulase significantly improve the saccharification efficiency of lignocellulosic biomass

Y Wang, A Wang, S Liu, L Li, Y Liu, Y Liu, G Nie… - Chemical Engineering …, 2024 - Elsevier
The introduction of specific choline chloride (ChCl)-and betaine (Bet)-based deep eutectic
solvents (DESs) into the conventional acetic acid–sodium acetate solution led to a …