Mario De bruyn, Vitaliy L. Budarin, Antonio Misefari, Seishi Shimizu, Heather Fish, Martin Cockett, Andrew J. Hunt, Heike Hofstetter, Bert M. Weckhuysen, James H. Clark and Duncan J. Macquarrie

ACS Sustainable Chem. Eng., 2019, 7, 7878
DOI: 10.1021/acssuschemeng.9b00470

Molecular Interpretation of Preferential Interactions in Protein Solvation: A Solvent-Shell Perspective by Means of Minimum-Distance Distribution Functions

Leandro Martínez and Seishi Shimizu

J. Chem. Theory Comput., 2017, 13, 6358
DOI: 10.1021/acs.jctc.7b00599

Aggregation Behavior and Thermodynamic Studies of Hydrotropes: A Review

Akash D. Patel and Meghal A. Desai

Tenside Surfactants Detergents, 2020, 57, 192
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The green solvent: a critical perspective

Neil Winterton

Clean Techn Environ Policy, 2021, 23, 2499
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Efficient Lignin Dissolution and Enzymatic Depolymerization in Ethylene Glycol-Based Deep Eutectic Solvent Mixtures: Integrated Experimental and Molecular Dynamics Study

Julian Schilke, Miriam Sprick, Eduardo Schneider, Josué Arturo Ledezma Fierro, Alexandre Pradal, Gabriele Raabe and Anett Schallmey

J. Phys. Chem. B, 2026, 130, 2361
DOI: 10.1021/acs.jpcb.5c07451

Searching for Sustainable Refrigerants by Bridging Molecular Modeling with Machine Learning

Ismail I. I. Alkhatib, Carlos G. Albà, Ahmad S. Darwish, Fèlix Llovell and Lourdes F. Vega

Ind. Eng. Chem. Res., 2022, 61, 7414
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Formulating rationally via statistical thermodynamics

Seishi Shimizu

Current Opinion in Colloid & Interface Science, 2020, 48, 53
DOI: 10.1016/j.cocis.2020.03.008

Solubility Enhancement of Hydrophobic Compounds in Aqueous Solutions Using Biobased Solvents as Hydrotropes

Sandra S. Silva, Dinis O. Abranches, Ana S. Pinto, Bruna P. Soares, Helena Passos, Ana M. Ferreira and João A. P. Coutinho

Ind. Eng. Chem. Res., 2023, 62, 12021
DOI: 10.1021/acs.iecr.3c01469

Statistical Thermodynamics Unveils How Ions Influence an Aqueous Diels‐Alder Reaction

Joshua E. S. J. Reid, Pedro H. G. Aquino, Adam J. Walker, Peter B. Karadakov and Seishi Shimizu

ChemPhysChem, 2019, 20, 1538
DOI: 10.1002/cphc.201900024

Progress in the field of hydrotropy: mechanism, applications and green concepts

Akash D. Patel and Meghal A. Desai

Reviews in Chemical Engineering, 2023, 39, 601
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A unified perspective on preferential solvation and adsorption based on inhomogeneous solvation theory

Seishi Shimizu and Nobuyuki Matubayasi

Physica A: Statistical Mechanics and its Applications, 2018, 492, 1988
DOI: 10.1016/j.physa.2017.11.113

Formation mechanism of surfactant-free microemulsion and a judgment on whether it can be formed in one ternary system

Ying Han, Ning Pan, Deqiang Li, Shuhui Liu, Bin Sun, Jinling Chai and Dejie Li

Chemical Engineering Journal, 2022, 437, 135385
DOI: 10.1016/j.cej.2022.135385

Application of machine learning in prediction of hydrotrope-enhanced solubilisation of indomethacin

Safa A. Damiati, Luigi G. Martini, Norman W. Smith, M. Jayne Lawrence and David J. Barlow

International Journal of Pharmaceutics, 2017, 530, 99
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Glycerol Ethers as Hydrotropes and Their Use to Enhance the Solubility of Phenolic Acids in Water

Bruna P. Soares, Dinis O. Abranches, Tânia E. Sintra, Alejandro Leal-Duaso, José Ignacio García, Elísabet Pires, Seishi Shimizu, Simão P. Pinho and João A. P. Coutinho

ACS Sustainable Chem. Eng., 2020, 8, 5742
DOI: 10.1021/acssuschemeng.0c01032

Effect of solute aggregation on solubilization

Seishi Shimizu and Yu Nagai Kanasaki

Journal of Molecular Liquids, 2019, 274, 209
DOI: 10.1016/j.molliq.2018.10.102

Formation Mechanism of Surfactant-Free Microemulsion and a Judgment on Whether it Can Be Formed in One Ternary System

Ying Han, Ning Pan, Deqiang Li, Shuhui Liu, Bin Sun, Jinling Chai and Dejie Li

SSRN Journal, 2022
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Kirkwood-Buff Analysis of Binary and Ternary Systems Consisting of Alcohols (Methanol, Ethanol, 1-Propanol, and 2-Propanol), Water, and n-Hexane to Understand the Formation of Surfactant-Free Microemulsions

Seungmin Seo, Hong-shik Lee and Tae Jun Yoon

J. Phys. Chem. B, 2024, 128, 5092
DOI: 10.1021/acs.jpcb.4c01563

Statistical thermodynamics of regular solutions and solubility parameters

Seishi Shimizu and Nobuyuki Matubayasi

Journal of Molecular Liquids, 2019, 273, 626
DOI: 10.1016/j.molliq.2018.10.024

Comprehensive study of a novel surfactant-free microemulsion including amyl acetate / ethanol / water: Simulation, properties and its applications in solubilization and material preparation

Ying Han, Wenjiao Liu, Ning Pan, Shuhui Liu, Akiko Nakabayashi, Jinling Chai, Yan Zhang and Dejie Li

Environmental Surfaces and Interfaces, 2025, 3, 196
DOI: 10.1016/j.esi.2025.09.001

Comparative analysis of molecular interactions in quaternary fluid system performed by classical and ab initio molecular dynamics

Alexander M. Toikka and Andrey V. Petrov

Mendeleev Communications, 2023, 33, 413
DOI: 10.1016/j.mencom.2023.04.036

Understanding Sorption Mechanisms Directly from Isotherms

Seishi Shimizu and Nobuyuki Matubayasi

Langmuir, 2023, 39, 6113
DOI: 10.1021/acs.langmuir.3c00256

Mechanism of dye solubilization and de-aggregation by urea

James M. Perry, Yu Nagai Kanasaki, Peter B. Karadakov and Seishi Shimizu

Dyes and Pigments, 2021, 193, 109530
DOI: 10.1016/j.dyepig.2021.109530

Characterizing the Effects of a “Switchable Water” Additive on the Aqueous Solubility of Small Molecules

Jesse R. Vanderveen, Sarika Burra, Jialing Geng, Alexandre Goyon, Alexander Jardine, Hyejin E. Shin, Tamer Andrea, Paul J. Dyson and Philip G. Jessop

ChemPhysChem, 2018, 19, 2093
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