OOIR: Observatory of International Research

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 2022-05-01 to 2026-05-01.)

Article	Citations
Molecular modeling and molecular dynamics investigations of water mediated diffusion of biogenic nanosilica into plant leaf’s epicuticular wax layer	442
Editorial Board	434
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)	369
Editorial Board	341
Fabrication and evaluation of the zoledronic acid loaded cationic starch-hydroxyapatite-ZrO2 nanocomposites for bone disease treatment	339
Encapsulation of 3-acetylcoumarin with acyclic cucurbit[n]urils: characterization/improved water solubility and thermal stability/retain biological activity	328
Synthesis of Adenosine 5-monophosphate monohydrate functionalized mesoporous Ag/CuO/MCM-41 nanostructures for enormous mineralization of insistent organic contaminants and photoinhibition of bacteria	280
Research on dissolution of actarit in aqueous mixtures: Solubility determination and correlation, preferential solvation, solvent effect and thermodynamics	278
Green synthesis and histo-toxicological study of 2,3-dihydroquinazolin-4(1H)-ones catalysed by novel cellulose supported Bronsted acidic ionic liquid	242
Enhancing solubility of organic crystalline ingredients in aqueous phase through preferential spatial association with polyols	229
Induced re-entrant SmA phase in binary mixtures of lactic acid derivatives	227
Coalescence of nanodroplets before critical miscibility: a case study of EtOH in 1,2 dichlorobenzene	184
Enhancing electrolyte performance: A DFT study of ethanol-enhanced 1-butyl-3-methylimidazolium tetrafluoroborate complex systems adsorption on graphene surface	181
Radiolytic degradation of β-lactam and tetracycline antibiotics in the presence of protein	173
SAFT-γ force field for the simulation of molecular fluids 9: Coarse-grained	168
Atomistic insights and tribological verification of partitioned functionalized graphene oxide dispersion properties	165
Experimental and theoretical study of the Favipiravir association in water solvent	153
Alternative approach to calculate thermodynamic enthalpy change ΔH for non-ideal fluids via equations of state	153
Rheology, viscoelasticity and microstructural properties of OAPB-SDS mixtures at different temperature and pH conditions	149
Study on adsorption behaviors of different cresols: First-principles calculation	144
Conformational analysis of etoricoxib: integrating NOESY spectroscopy and quantum-chemical calculations for polymorph screening	142
Probing host guest inclusion complex and its applications by biophysical approach subsequently optimized by molecular docking	138
Modeling viscosity of SiO2-Al2O3-CaO based slags using Arrhenius and VFT models as well as the CALPHAD method	138
Structural elucidation, solvent (polar and non-polar) effect on electronic characterization, non-covalent charge interaction nature, topology and pharmacological studies on NLO active -argininium met	137
Molecular simulation on structural and molecular properties of polymer-blend nanoparticles	129

Synthesis and performance of piperidinium-based ionic liquids as catalyst for biomass conversion into 3-acetamido-5-acetylfuran	127
Carbon dioxide interaction with a series of ionic liquids consisting of fluorophenyltrifluoroborate anions studied by in situ ATR-FTIR spectroscopy	121
Study of the effect of high-temperature activation of quartz on the adsorption of gold cyanide	119
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 s	114
One-pot synthesized multifunctional carbon nitride dots for fluorescent sensing, bioimaging, and selective cytotoxic effect on cancer cells	111
Construction and modulation of dual responsive AIE supramolecular aggregates combined with quantum chemistry simulation	111
Squaric acid driven supramolecular metallogels of Cd(II) and Zn(II): Sensitive inhibitors for multi-drug resistance ESKAPE pathogens	110
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 method	110
High efficiency dye adsorption and oil–water separation of aminated-SiO2 decorated monolayer Ti3C2Tx MXene	109
Structural and electronic impacts on corrosion inhibition activity of novel heterocyclic carboxamides derivatives on mild steel in 1 M HCl environment: Experimental and theoretical approaches	106
Monte Carlo simulation for the effect of chain stiffness on the free surface of polymer melts	105
Next-generation biodegradable ionic liquids based on DNA nucleotide and amino acids: MM/QM/MD design, synthesis, and characterization	103
Experimental and theoretical investigation of water sorption on lemon leaves: New perspectives with statistical physical modeling	103
Evaluation of the influence of surface structure on tribological properties of the solid–liquid interface: Analytical and experimental assessment	101
Molecular dynamic investigation on the thermophysical properties of binary molten carbonate mixtures	99
Integrating DFT-guided design and green natural deep eutectic solvent chemistry for efficient keratin dissolution and recovery from wool waste	97
1D NOESY study of bicalutamide conformations in a supercritical CO2	96
Gelation at oil–water interface by using dimethylcyclohexylamine/fatty acid-based surface-active ionic liquids	95
Effects of hydrogen-bonding functional groups of ammonium based-ionic liquids with Tf2N anion on the upper critical solution temperature in aqueous solutions	94
Understanding the pH-responsive behaviour of alkylamine surfactants	94
Mechanisms of surfactant improving water injection huff and puff efficiency in tight reservoir	93
Neutral polymer-pseudo polyelectrolyte transition of a post irradiated polymer dissolved in water	92
Hansen solubility parameters and green nanocarrier based removal of trimethoprim from contaminated aqueous solution	92
Editorial Board	90
Editorial Board	90
Entropy-driven conformational transition of flexible Z-DNA to a novel non-B helix by double-methylated guanosine	89
Multiwavelength spectrophotometric-thermodynamic studies of complexation reactions of newly synthesized triazenes with Hg2+, Pb2+, Zn2+, and Cd2+ in MeOH, EtOH, DMF, and DMSO	89
Topological descriptors and Laplace spectra in simple hydrogen bonded systems	89
Activation induced fluidization of a confined viscous liquid	88
Molecular insights into the compression response of nitrogen/tetrafluoromethane liquid mixture from ab initio molecular dynamics	87
Editorial Board	87
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 state	86
Mechanisms of electric field-induced interactions between nanodroplets transmitted through a graphene monolayer	86
Synthesis of carboxyl group functionalized polyhedral oligomeric silsesquioxane for fabricating ultrastable foams driven by high temperature and salinity	86
Study for removing of silica nanoparticle in pure isopropyl alcohol with a cation exchange membrane	86
Simulation study of solvent effect on competitive degradation of aggregation of homo- and hetero- amyloid-β dimers	86
Investigation of polymer−surfactant complexes by both micellar solubilization and pre-column derivatization capillary electrophoresis	85
Molecular interactional study of SDS and CTAB in aqueous medium of anti-HIV drugs (Emtricitabine and Lamivudine) at different temperatures: A physicochemical investigation	84
Comparative study on the physicochemical properties of N-SO3H functionalized ammonium and imidazolium ionic liquids	84
Density, critical point, and the structure of supercritical ethanol–water mixtures	84
Synthesis and mesomorphism of 3,4-dialkoxyphenylpyridine complexes of silver(I)	83
Thermodynamic characterization of lysozyme-NAG3 binding in salt-rich mimetic extraterrestrial environments: Implications for protein function	83
Achieving accurate entropy and melting point by ab initio molecular dynamics and zentropy theory: Application to fluoride and chloride molten salts	83
Nutraceutical formulated oil-in-water emulsion: Synthesis, characterization and biological applications	82
Inhibition of human epidermal growth factor receptor-2 protein by some alkaloid inhibitors	81
Polymer-stabilized blue phase liquid crystal devices with ultra-low hysteresis and driving stability	81
Hydrophobic solvation and liquid water: A theoretical investigation using thermodynamic perturbation and integral equations theory	81
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-octanedione	80
Insight into intermolecular interactions in ethyl acetate + alkyl acrylate binary systems at different temperatures by means of volumetric, ultrasonic, viscometric and optical properties: Experimental	80
Design, antibacterial activity, computational analysis and molecular modeling study of a novel diimine-dioxime ligand and its Cu(II) complex	79

Editorial Board	79
Interaction of linezolid-bound magnetic iron oxide nanoparticle to β-cyclodextrin/DNA	78
1,3-Propanediol extraction from aqueous phase using hydrophobic eutectic solvents: Insights from experiments and molecular dynamics simulations	77
Spectroscopic and computational study of molecular interaction of Pexidartinib with homologous mammalian transport proteins	77