Density of deep eutectic solvents: the path forward cheminformatics-driven reliable predictions for mixtures

AK Halder, R Haghbakhsh, IV Voroshylova… - Molecules, 2021 - mdpi.com
Deep eutectic solvents (DES) are often regarded as greener sustainable alternative solvents
and are currently employed in many industrial applications on a large scale. Bearing in mind …

Comprehensive prediction of densities for deep eutectic solvents: a new bonding-group interaction contribution scheme

XJ Hou, LY Yu, YX Wang, KJ Wu… - Industrial & Engineering …, 2021 - ACS Publications
Deep eutectic solvents (DESs) with benign properties as green alternatives are being
preferred for a multitude of energy conversion and environmental protection processes and …

Accurate machine learning for predicting the viscosities of deep eutectic solvents

M Mohan, KD Jetti, MD Smith… - Journal of Chemical …, 2024 - ACS Publications
Deep eutectic solvents (DESs) are emerging as environmentally friendly designer solvents
for mass transport and heat transfer processes in industrial applications; however, the lack of …

Thermodynamic and Transport Properties Modeling of Deep Eutectic Solvents: A Review on gE-Models, Equations of State, and Molecular Dynamics

A González de Castilla, JP Bittner… - Journal of chemical & …, 2019 - ACS Publications
Deep eutectic solvents (DESs) have gained attention in recent years as attractive
alternatives to traditional solvents. There is a growing number of publications dealing with …

DESignSolvents: an open platform for the search and prediction of the physicochemical properties of deep eutectic solvents

V Odegova, A Lavrinenko, T Rakhmanov, G Sysuev… - Green …, 2024 - pubs.rsc.org
The use of organic solvents in various industries poses significant environmental risks. Deep
eutectic solvents (DESs) have emerged as a promising alternative due to their …

Predicting the Surface Tension of Deep Eutectic Solvents: A Step Forward in the Use of Greener Solvents

AK Halder, R Haghbakhsh, IV Voroshylova… - Molecules, 2022 - mdpi.com
Deep eutectic solvents (DES) are an important class of green solvents that have been
developed as an alternative to toxic solvents. However, the large-scale industrial application …

Machine learning coupled with group contribution for predicting the density of deep eutectic solvents

A Roosta, R Haghbakhsh, ARC Duarte, S Raeissi - Fluid Phase Equilibria, 2023 - Elsevier
Abstract Deep Eutectic Solvents (DESs) are a recently introduced class of green solvents
with unique and favorable characteristics. Despite their recent debut, the scientific …

Simple and global correlation for the densities of deep eutectic solvents

R Haghbakhsh, R Bardool, A Bakhtyari… - Journal of Molecular …, 2019 - Elsevier
Deep eutectic solvents (DESs) mostly comply with the principles of green chemistry.
Therefore, they are being widely investigated due to their great potential for a variety of …

Simulation of deep eutectic solvents: Progress to promises

C Velez, O Acevedo - Wiley Interdisciplinary Reviews …, 2022 - Wiley Online Library
Deep eutectic solvents (DESs) are binary or ternary mixtures of compounds that possess
significant melting point depressions relative to the pure isolated components. The discovery …

Perspectives and guidelines on thermodynamic modelling of deep eutectic solvents

III Alkhatib, D Bahamon, F Llovell… - Journal of Molecular …, 2020 - Elsevier
In the quest for green and sustainable solvents, deep eutectic solvents (DESs) have
emerged as an attractive and multipurpose material with demonstrated applicability in …