Computer simulations of deep eutectic solvents: Challenges, solutions, and perspectives

D Tolmachev, N Lukasheva, R Ramazanov… - International journal of …, 2022 - mdpi.com
Deep eutectic solvents (DESs) are one of the most rapidly evolving types of solvents,
appearing in a broad range of applications, such as nanotechnology, electrochemistry …

In competition for water: hydrated choline chloride: urea vs choline acetate: urea deep eutectic solvents

ME Di Pietro, M Tortora, C Bottari… - ACS Sustainable …, 2021 - ACS Publications
Unlike the archetypal deep eutectic solvent (DES) choline chloride: urea (ChCl: U),
fundamental knowledge of the intermolecular network in choline acetate (ChOAc) DESs and …

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 …

Asymmetric Reduction of Cyclic Imines by Imine Reductase Enzymes in Non‐Conventional Solvents

D Arnodo, F De Nardi, S Parisotto, E De Nardo… - …, 2024 - Wiley Online Library
The first enantioselective reduction of 2‐substituted cyclic imines to the corresponding
amines (pyrrolidines, piperidines, and azepines) by imine reductases (IREDs) in non …

Transition of a deep eutectic solution to aqueous solution: A dynamical perspective of the dissolved solute

SS Sakpal, SH Deshmukh, S Chatterjee… - The Journal of …, 2021 - ACS Publications
Disruption of the deep eutectic solvent (DES) nanostructure around the dissolved solute
upon addition of water is investigated by polarization-selective two-dimensional infrared …

Absorption of volatile organic compounds toluene and acetaldehyde in choline chloride-based deep eutectic solvents

S Indra, R Subramanian… - The Journal of Physical …, 2022 - ACS Publications
Unrestricted emission of volatile organic compounds (VOCs)─ a threat to human health and
the environment─ can be controlled to a large extent by the capturing mechanism. Few …

Does variation in composition affect dynamics when approaching the eutectic composition?

S Chatterjee, T Chowdhury, S Bagchi - The Journal of Chemical …, 2023 - pubs.aip.org
Deep eutectic solvent is a mixture of two or more components, mixed in a certain molar ratio,
such that the mixture melts at a temperature lower than individual substances. In this work …

Low-frequency spectra of reline and its mixtures with water: A comparative study based on femtosecond Raman-induced Kerr effect spectroscopy and molecular …

H Shirota, J Rajbangshi, M Koyakkat, A Baksi… - … of Photochemistry and …, 2023 - Elsevier
In this study, we investigated the low-frequency spectra below 650 cm− 1 of aqueous reline
solutions with various concentrations via femtosecond Raman-induced Kerr effect …

On the not so anomalous water-induced structural transformations of choline chloride–urea (reline) deep eutectic system

H Monteiro, A Paiva, ARC Duarte… - Physical Chemistry …, 2023 - pubs.rsc.org
The choline chloride–urea binary mixture in the molar ratio (1: 2), commonly known as
reline, is an archetypal solvent among deep eutectic solvents (DES). Neutron diffraction …

Osmolyte-induced conformational stabilization of a hydrophobic polymer

P Nanavare, S Sarkar, AB Jena… - Physical Chemistry …, 2024 - pubs.rsc.org
Elucidating the mechanistic role of osmolytes on conformations of hydrophobic prototypical
macromolecules in principle is the stepping stone towards understanding the effect of …