Journal of Molecular Liquids

Papers
(The H4-Index of Journal of Molecular Liquids is 77. The table below lists those papers that are above that threshold based on CrossRef citation counts [max. 250 papers]. The publications cover those that have been published in the past four years, i.e., from 2022-06-01 to 2026-06-01.)
ArticleCitations
Molecular modeling and molecular dynamics investigations of water mediated diffusion of biogenic nanosilica into plant leaf’s epicuticular wax layer448
Editorial Board443
Comment to the article “A crucial incorrect understanding in the traditional solution theory” from Zhong-Hua Yang and Kun-Peng Yang (J. Molecular Liq. 310 (2020) 112379)382
Editorial Board344
Fabrication and evaluation of the zoledronic acid loaded cationic starch-hydroxyapatite-ZrO2 nanocomposites for bone disease treatment342
Encapsulation of 3-acetylcoumarin with acyclic cucurbit[n]urils: characterization/improved water solubility and thermal stability/retain biological activity341
Synthesis of Adenosine 5-monophosphate monohydrate functionalized mesoporous Ag/CuO/MCM-41 nanostructures for enormous mineralization of insistent organic contaminants and photoinhibition of bacteria333
Research on dissolution of actarit in aqueous mixtures: Solubility determination and correlation, preferential solvation, solvent effect and thermodynamics288
Green synthesis and histo-toxicological study of 2,3-dihydroquinazolin-4(1H)-ones catalysed by novel cellulose supported Bronsted acidic ionic liquid234
Coalescence of nanodroplets before critical miscibility: a case study of EtOH in 1,2 dichlorobenzene234
Alternative approach to calculate thermodynamic enthalpy change ΔH for non-ideal fluids via equations of state186
Experimental and theoretical study of the Favipiravir association in water solvent181
Rheology, viscoelasticity and microstructural properties of OAPB-SDS mixtures at different temperature and pH conditions178
Study on adsorption behaviors of different cresols: First-principles calculation173
Conformational analysis of etoricoxib: integrating NOESY spectroscopy and quantum-chemical calculations for polymorph screening167
Modeling viscosity of SiO2-Al2O3-CaO based slags using Arrhenius and VFT models as well as the CALPHAD method156
Probing host guest inclusion complex and its applications by biophysical approach subsequently optimized by molecular docking154
Structural elucidation, solvent (polar and non-polar) effect on electronic characterization, non-covalent charge interaction nature, topology and pharmacological studies on NLO active -argininium met149
Synthesis and performance of piperidinium-based ionic liquids as catalyst for biomass conversion into 3-acetamido-5-acetylfuran145
Carbon dioxide interaction with a series of ionic liquids consisting of fluorophenyltrifluoroborate anions studied by in situ ATR-FTIR spectroscopy144
Study of the effect of high-temperature activation of quartz on the adsorption of gold cyanide141
DFT-details & atomic-scale MC/MD simulations and experimental exploration of the Silybum extract bio-molecules effectiveness in mitigating aggressive effects of simulated corrosive concrete pore s140
One-pot synthesized multifunctional carbon nitride dots for fluorescent sensing, bioimaging, and selective cytotoxic effect on cancer cells137
Insight to the thermodynamic properties and intermolecular interplay of ether-based ionic liquid mixtures composed of [C1OC2mPy][NTf2] and ACN/ GBL by a combined experimental and computational method129
Construction and modulation of dual responsive AIE supramolecular aggregates combined with quantum chemistry simulation129
Squaric acid driven supramolecular metallogels of Cd(II) and Zn(II): Sensitive inhibitors for multi-drug resistance ESKAPE pathogens125
High efficiency dye adsorption and oil–water separation of aminated-SiO2 decorated monolayer Ti3C2Tx MXene119
Structural and electronic impacts on corrosion inhibition activity of novel heterocyclic carboxamides derivatives on mild steel in 1 M HCl environment: Experimental and theoretical approaches115
Monte Carlo simulation for the effect of chain stiffness on the free surface of polymer melts114
Experimental and theoretical investigation of water sorption on lemon leaves: New perspectives with statistical physical modeling114
Next-generation biodegradable ionic liquids based on DNA nucleotide and amino acids: MM/QM/MD design, synthesis, and characterization112
Evaluation of the influence of surface structure on tribological properties of the solid–liquid interface: Analytical and experimental assessment110
Molecular dynamic investigation on the thermophysical properties of binary molten carbonate mixtures109
Integrating DFT-guided design and green natural deep eutectic solvent chemistry for efficient keratin dissolution and recovery from wool waste106
1D NOESY study of bicalutamide conformations in a supercritical CO2105
Gelation at oil–water interface by using dimethylcyclohexylamine/fatty acid-based surface-active ionic liquids103
Effects of hydrogen-bonding functional groups of ammonium based-ionic liquids with Tf2N anion on the upper critical solution temperature in aqueous solutions101
Neutral polymer-pseudo polyelectrolyte transition of a post irradiated polymer dissolved in water99
Hansen solubility parameters and green nanocarrier based removal of trimethoprim from contaminated aqueous solution98
Editorial Board97
Topological descriptors and Laplace spectra in simple hydrogen bonded systems97
Editorial Board97
Entropy-driven conformational transition of flexible Z-DNA to a novel non-B helix by double-methylated guanosine96
Multiwavelength spectrophotometric-thermodynamic studies of complexation reactions of newly synthesized triazenes with Hg2+, Pb2+, Zn2+, and Cd2+ in MeOH, EtOH, DMF, and DMSO96
Activation induced fluidization of a confined viscous liquid95
Editorial Board94
Simulation study of solvent effect on competitive degradation of aggregation of homo- and hetero- amyloid-β dimers93
Synthesis of carboxyl group functionalized polyhedral oligomeric silsesquioxane for fabricating ultrastable foams driven by high temperature and salinity92
Liquid-liquid equilibrium of binary ethanol–polyisobutene and ternary ethanol–water–polyisobutene systems under low- and high-pressure conditions: An assessment using the PC-SAFT equation of state91
Study for removing of silica nanoparticle in pure isopropyl alcohol with a cation exchange membrane90
Thermodynamic characterization of lysozyme-NAG3 binding in salt-rich mimetic extraterrestrial environments: Implications for protein function89
Mechanisms of electric field-induced interactions between nanodroplets transmitted through a graphene monolayer89
Comparative study on the physicochemical properties of N-SO3H functionalized ammonium and imidazolium ionic liquids89
Molecular interactional study of SDS and CTAB in aqueous medium of anti-HIV drugs (Emtricitabine and Lamivudine) at different temperatures: A physicochemical investigation89
Polymer-stabilized blue phase liquid crystal devices with ultra-low hysteresis and driving stability88
Highly efficient mutual separation of Nd-Pr by the selective dissolution of Nd into an ionic liquid containing1,1,1,2,2,3,3-heptafluoro-7,7-dimethyl-4,6-octanedione88
Synthesis and mesomorphism of 3,4-dialkoxyphenylpyridine complexes of silver(I)88
Inhibition of human epidermal growth factor receptor-2 protein by some alkaloid inhibitors88
Editorial Board87
Design, antibacterial activity, computational analysis and molecular modeling study of a novel diimine-dioxime ligand and its Cu(II) complex86
1,3-Propanediol extraction from aqueous phase using hydrophobic eutectic solvents: Insights from experiments and molecular dynamics simulations86
Interaction of linezolid-bound magnetic iron oxide nanoparticle to β-cyclodextrin/DNA86
Experimental and theoretical study of 2-mercaptopyridine as an effective eco-friendly inhibitor for copper in aqueous NaCl85
EGylated deep eutectic solvent influenced micellization behaviour of [C6mim][Br] ionic liquid in aqueous solutions84
The diffusion characteristics of POSS under electric field and non-uniform temperature field in natural ester insulating oil84
Investigation of micellization and thermodynamic properties of cationic gemini surfactant (12-2-O-2-12) in the presence of organic solvents83
Silver nanoparticles modified titanium carbide MXene composite for RSM-CCD optimised chloride removal from water83
Co-loading of doxorubicin and anti-cancer peptide LL-37 on covalently functionalized carbon nanotubes; a molecular dynamics simulation study83
Supramolecular-based preparation of deep eutectic solvents synergized with carbon nanotubes for oxidative desulfurization of fuels82
Retention characteristics, saturated vapor pressure and vaporization enthalpy of mesityl oxide ethers of linear alcohols C1–C582
Study on OH radical oxidation of 4H-SiC in plasma based on ReaxFF molecular dynamics simulation81
Comprehensive thermodynamic modeling framework for the estimation of physico-chemical properties of deep eutectic solvent-heavy crude oil system81
The role of NH80
Growing nanoparticles to assemble a modern three-dimensional nanoarchitecture of Pt-Ru aerogel for advanced electrocatalysis80
Dynamic light scattering for the determination of linoleic acid critical micelle concentration. Effect of pH, ionic strength, and ethanol80
Interfacial behavior and emulsion stability of lipid delivery system regulated by two-dimensional facial amphiphiles bile salts79
Tribological behavior of two novel choline acetate-based deep eutectic solvents78
Acylhydrazone-functionalized triphenylamine V-shaped liquid crystals: Synthesis, columnar self-assembly, gel property and application for the detection of Cu2+77
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