ReviewInternational journal of molecular sciences2022
Computer Simulations of Deep Eutectic Solvents: Challenges, Solutions, and Perspectives.
Review in International journal of molecular sciences, 2022. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 21 papers.
What it found
Each row is one number read from the abstract, on the scale the paper reported it, with its interval. Left of the dashed line favours the treatment, right favours the comparator. Under each row is the sentence it came from. New to these charts? A ten-minute tutorial.
The abstract states no effect estimate the extractor could read, or names no intervention and outcome on the map, so this paper lights no cell and moves no belief. It is still indexed, cited and linked below.
The trial behind it
Trials whose registry record cites this paper, or whose number appears in the abstract. A trial that started after this paper was published is citing it as background, not reporting it.
Neither the registry nor the abstract names a trial number. If this is a trial report, that itself is worth knowing.
Who cites it
21 citing papers in PubMed.
- Beyond Composition: Structure-Activity Relationships in Bioactive Deep Eutectic Systems.Pharmaceutics · 2026Review
- Molecular Insight into the Structural Properties of Deep Eutectic Solvents Based on Alkanolamines-A Theoretical and Experimental Study.Molecules (Basel, Switzerland) · 2026Article
- Pretreatment of Wheat Straw with N-Alkyltrimethylammonium Bromide in Deep Eutectic Solvent: A Collaborative Exploration of Experiment and Simulation.Applied biochemistry and biotechnology · 2026Article
- Deep eutectic solvents as an emerging platform for microbial carotenoids extraction: State of the art, prospects, and challenges.Food chemistry: X · 2026Review
- Current Status and Future Perspectives of Betaine and Betaine-Based Natural Deep Eutectic Solvents: A Review.Foods (Basel, Switzerland) · 2025Review
- Deep eutectic solvent-mediated valorization of waste feathers into highly digestible antioxidant peptides for sustainable feed protein.Food chemistry: X · 2025Article
- Molecular Dynamics Simulation of Fatty Acid Extraction Using a Type V Deep Eutectic Solvent with Tunable Hydrophobicity.The journal of physical chemistry. B · 2025Article
- Catalytic acidic deep eutectic mixture for efficient and promising synthesis of quinazolinone and quinoxaline derivatives.RSC advances · 2025Article
- Deep Eutectic Solvents Meet Non-Aqueous Cosolvents: A Modeling and Simulation Perspective-A Tutorial Review.Journal of chemical and engineering data · 2025Review
- Computer-Assisted Strategies as a Tool for Designing Green Monomer-Based Molecularly Imprinted Materials.International journal of molecular sciences · 2024Review
- Machine-Learning-Assisted Design of Deep Eutectic Solvents Based on Uncovered Hydrogen Bond Patterns.Engineering (Beijing, China) · 2024Article
- Predicting the formation of NADES using a transformer-based model.Scientific reports · 2024Article
- Extraction and Purification of Aucubin fromACS omega · 2024Article
- Alternative Assisted Extraction Methods of Phenolic Compounds Using NaDESs.Antioxidants (Basel, Switzerland) · 2023Review
- Nature of a Tetrabutylammonium Chloride-Levulinic Acid Deep Eutectic Solvent.Industrial & engineering chemistry research · 2023Article
- Enhanced Polyphenols Recovery from Grape Pomace: A Comparison of Pressurized and Atmospheric Extractions with Deep Eutectic Solvent Aqueous Mixtures.Antioxidants (Basel, Switzerland) · 2023Article
- Enhanced extraction of phenolic compounds from mango by-products using deep eutectic solvents.Heliyon · 2023Article
- Water Influence on the Physico-Chemical Properties and 3D Printability of Choline Acrylate-Bacterial Cellulose Inks.Polymers · 2023Article
- Rational In Silico Design of Molecularly Imprinted Polymers: Current Challenges and Future Potential.International journal of molecular sciences · 2023Review
- Natural Deep Eutectic Solvents in the Synthesis of Inorganic Nanoparticles.Materials (Basel, Switzerland) · 2023Review
Corrections and comments
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Authors and funding
16 authors.
Funding
Abstract
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, biomass transformation, pharmaceuticals, membrane technology, biocomposite development, modern 3D-printing, and many others. The range of their applicability continues to expand, which demands the development of new DESs with improved properties. To do so requires an understanding of the fundamental relationship between the structure and properties of DESs. Computer simulation and machine learning techniques provide a fruitful approach as they can predict and reveal physical mechanisms and readily be linked to experiments. This review is devoted to the computational research of DESs and describes technical features of DES simulations and the corresponding perspectives on various DES applications. The aim is to demonstrate the current frontiers of computational research of DESs and discuss future perspectives.
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What OpenQuestion holds
Registered trials
Read under generation 80e0d062 · epoch 390. Bibliography from PubMed, PubMed Central and OpenAlex; grants from NIH RePORTER; trial links from ClinicalTrials.gov; estimates, votes and beliefs from the OpenQuestion graph.