Journal of Molecular Liquids

Article	Citations
Molecular modeling and molecular dynamics investigations of water mediated diffusion of biogenic nanosilica into plant leaf’s epicuticular wax layer	502
Editorial Board	485
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)	480
Editorial Board	422
Fabrication and evaluation of the zoledronic acid loaded cationic starch-hydroxyapatite-ZrO2 nanocomposites for bone disease treatment	357
Encapsulation of 3-acetylcoumarin with acyclic cucurbit[n]urils: characterization/improved water solubility and thermal stability/retain biological activity	351
Green synthesis and histo-toxicological study of 2,3-dihydroquinazolin-4(1H)-ones catalysed by novel cellulose supported Bronsted acidic ionic liquid	344
Coalescence of nanodroplets before critical miscibility: a case study of EtOH in 1,2 dichlorobenzene	318
Alternative approach to calculate thermodynamic enthalpy change ΔH for non-ideal fluids via equations of state	253
Rheology, viscoelasticity and microstructural properties of OAPB-SDS mixtures at different temperature and pH conditions	245
Study on adsorption behaviors of different cresols: First-principles calculation	197
Probing host guest inclusion complex and its applications by biophysical approach subsequently optimized by molecular docking	194
Construction and modulation of dual responsive AIE supramolecular aggregates combined with quantum chemistry simulation	190
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	177
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	176
Monte Carlo simulation for the effect of chain stiffness on the free surface of polymer melts	166
Experimental and theoretical investigation of water sorption on lemon leaves: New perspectives with statistical physical modeling	152
Evaluation of the influence of surface structure on tribological properties of the solid–liquid interface: Analytical and experimental assessment	148
Integrating DFT-guided design and green natural deep eutectic solvent chemistry for efficient keratin dissolution and recovery from wool waste	147
Gelation at oil–water interface by using dimethylcyclohexylamine/fatty acid-based surface-active ionic liquids	146
Neutral polymer-pseudo polyelectrolyte transition of a post irradiated polymer dissolved in water	146
Hansen solubility parameters and green nanocarrier based removal of trimethoprim from contaminated aqueous solution	134
Editorial Board	123
Editorial Board	120
Entropy-driven conformational transition of flexible Z-DNA to a novel non-B helix by double-methylated guanosine	119

Topological descriptors and Laplace spectra in simple hydrogen bonded systems	119
Activation induced fluidization of a confined viscous liquid	116
Editorial Board	111
Simulation study of solvent effect on competitive degradation of aggregation of homo- and hetero- amyloid-β dimers	111
Synthesis of carboxyl group functionalized polyhedral oligomeric silsesquioxane for fabricating ultrastable foams driven by high temperature and salinity	111
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	109
Molecular interactional study of SDS and CTAB in aqueous medium of anti-HIV drugs (Emtricitabine and Lamivudine) at different temperatures: A physicochemical investigation	104
Study for removing of silica nanoparticle in pure isopropyl alcohol with a cation exchange membrane	104
Comparative study on the physicochemical properties of N-SO3H functionalized ammonium and imidazolium ionic liquids	104
Thermodynamic characterization of lysozyme-NAG3 binding in salt-rich mimetic extraterrestrial environments: Implications for protein function	102
Synthesis and mesomorphism of 3,4-dialkoxyphenylpyridine complexes of silver(I)	101
Editorial Board	100
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	100
Interaction of linezolid-bound magnetic iron oxide nanoparticle to β-cyclodextrin/DNA	99
EGylated deep eutectic solvent influenced micellization behaviour of [C6mim][Br] ionic liquid in aqueous solutions	99
The diffusion characteristics of POSS under electric field and non-uniform temperature field in natural ester insulating oil	99
Design, antibacterial activity, computational analysis and molecular modeling study of a novel diimine-dioxime ligand and its Cu(II) complex	99
Investigation of micellization and thermodynamic properties of cationic gemini surfactant (12-2-O-2-12) in the presence of organic solvents	97
Co-loading of doxorubicin and anti-cancer peptide LL-37 on covalently functionalized carbon nanotubes; a molecular dynamics simulation study	97
Supramolecular-based preparation of deep eutectic solvents synergized with carbon nanotubes for oxidative desulfurization of fuels	96
Comprehensive thermodynamic modeling framework for the estimation of physico-chemical properties of deep eutectic solvent-heavy crude oil system	94
Retention characteristics, saturated vapor pressure and vaporization enthalpy of mesityl oxide ethers of linear alcohols C1–C5	94
Charge-transfer chemistry of two corticosteroids used adjunctively to treat COVID-19. Part II: The CT reaction of hydrocortisone and dexamethasone donors with TCNQ and fluoranil acceptors in five orga	94
Ionic complexes in liquid Li–K–Pb alloys	93
Optimizing the efficient removal of ibuprofen from water environment by magnetic carbon aerogel: kinetics, isotherms, and thermodynamic studies	93
Molecular dynamic simulations on wetting transition of nanofluid on a single grooved structure	92
Quantitative analysis of cordycepin's solvent-dependent thermodynamics: decoding hydrogen-bonding interactions via COSMO-RS σ-profiling	91
Calculation of the formation enthalpies of charge-transfer complexes with iodine from the binding constants at 298.15 K	91
Molecular-level insights into naproxen sodium adsorption on activated carbons using advanced multilayer modeling	90
Rheology of high-temperature resistant fracturing fluids formed by VES, acids and oxidants for enhancing CO2 injection in deep coal seams	90
Corrigendum to “Densities and viscosities of (ethylene glycol - water) and (1,3-propanediol - water) binary mixtures at high temperatures of 373.2 and 473.2 K and high pressures up to 40 MPa” [J Mol.	89
Corrigendum to “Incorporation of MgO-humic acid in iron oxide based magnetic composite facilitates for effective remediation of lead, arsenic and bacterial effect in water” [J.Mol. Liquids 380 (2023)	88
Retraction notice to “Structural (monomer and dimer), wavefunctional, NCI analysis in aqueous phase, electronic and excited state properties in different solvent atmosphere of 3-{(E)-[(3,4-dichlorophe	88
Experimental study on binary (solid + liquid) equilibrium and solubility analysis of N-fluorobenzenesulfonimide in 16 organic solvents at temperatures ranging from 273.35 to 322.85 K under 101.3 kPa	88
The concept of instantaneous supramolecules and its application to simulating the thermal conductivity of water-ethylene glycol mixtures	87
Self-assembly and phase transition of gold nanoclusters in natural deep eutectic solvent for visual detection of toxicants in water environment	85
Unveiling the influence of fluorine substitution on NLO and vibrational Properties: A computational exploration of N-(4-decylphenyl)-1-(4-(pentyloxy)phenyl)methanimine liquid crystal derivatives	85
Solubility of glimepiride in mono- and mixed-solvents at various temperatures: Proposing practical strategy for industrial applications	85
Synthesis of nanomesoporous magnetic metal–organic framework of Fe3O4@SiO2-SBA-3-MIL-100(Fe)/SO3H for citalopram adsorption from aqueous phase: experimental and DFT studies	85
Encapsulation of the quercetin with interpolyelectrolyte complex based on pillar[5]arenes	84
Self-assembly modulation in star block copolymers by amphiphilic diol: A scattering insight	84
Advances in ionic liquids for Parkinson's disease: from detection to in-vitro analysis	84
Complex formation of Zinc(II) ion with acetonitrile in ionic liquid [C2mim][TFSA] studied by 15N NMR spectroscopy and DFT calculation	83
Molecular dynamics study on bubble nucleation characteristics on rectangular Nano-Grooved surfaces	81
Vapor-liquid equilibrium for dimethyl ether and three imidazolium ionic liquids as working pairs in absorption-refrigeration cycle	80
Effect of hydroxyl group on foam features of hydroxyl-based anionic ionic liquid surfactant: Experimental and theoretical studies	80
Polarizabilities and electric field-induced forces in periodic two-component linear dielectric sphere chains	80
Double-Brønsted acidic deep eutectic solvents and their applications as solvents and catalysts in chemical transformations	78
A molecular dynamic insight into CO2 diffusion of type III porous liquids	78
Photophysical study on synthesized triazolium ionic liquids and their stabilizing effect on native state of serum albumin	78

Poly(tannic acid)-functionalized onion-like carbon nanoparticles derived from candle soot serving as potent lubricant additives	77
DFT study of difluoro & trifluoro bi-cyclohexane based dimer for application in electronic and optical devices	76
Molecular simulation study of methane hydrate decomposition in the presence of hydrophilic and hydrophobic solid surfaces	75
Volumetric, transport and acoustic properties of binary mixtures containing alkanol at 298.15–318.15 K	75
An efficient malachite sulfidation flotation reagent system: CaSx- potassium n-butoxypropyl xanthate	75
Synthesis, characterization, toxicity evaluation and inhibitory effect of hesperitin-copper (Ⅱ) complex on xanthine oxidase	74
Utilizing different machine learning methods to accurately predict density, temperature, velocity, and thermal conductivity of hydrophilic, hydrophobic, and compound materials	73
Physicochemical properties of ionic liquids with indole removal function	73
Difference in the hydration state of water at the hydrophobic interface of structural isomers of propanol investigated by U.V visible absorption and Raman spectroscopic study	73
Grafting tetradecyl methacrylate-carbic anhydride (CA) or tetradecyl methacrylate-tetrahydrophthalic anhydride (THPA) co-polymers onto surface-modified nano silica to develop of pour point depressants	72
Full relaxation dynamics recovery from ultrafast fluorescence experiments by means of the stochastic model: Does the solvent response dynamics depend on the fluorophore nature?	72
Investigating the Age-Dependent behavior of MoS2-hBN nanohybrid additives on the rheological properties of diesel engine oil	72
Local stress within a granular molecular solvent matrix, a mechanism for individual ion hydration	72
Linear hydrophobic congeneric groups of bile acid anion derivatives based on the self-association (micellization) process and the phenomenon of enthalpy–entropy compensation	72
Affinity and putative entrance mechanisms of alkyl sulfates into the β-CD cavity	71
SAFT- γ	71
Ionic liquids beyond the solvent: structure–activity design for tunable luminescence and next-generation photonic applications	70
In silico design of a multi-epitope vaccine against Providencia Stuartii using reverse vaccinology and immunoinformatics approaches	70
Molecular insights into the compression response of nitrogen/tetrafluoromethane liquid mixture from ab initio molecular dynamics	70
Structural transition of a nanodroplet under an alternating electric field: Understandings and predictions from a dynamic density functional theory	69
Influence of water penetration on glass fiber-epoxy resin interface under electric field: A DFT and molecular dynamics study	69
A comparative study for molecular insight on riparins (I–III) by quantum chemical, spectroscopic, and molecular docking methods	69
A new magnetically separable zwitterionic copolymer hydrogel: Synthesis, characterization, and adsorption studies	69
A DFT-based study on CFBP: Structural, solvent spectroscopic analysis and ligand protein interaction with the antipsychotic characteristics	69
Thermal hysteresis of mesoscopic phase transitions in fluid metals: From tantalum to aluminum and gold with their critical points and non-mean-field global diagrams	69
Molecular aggregation effect on the antagonistic adsorption of pharmaceuticals from aqueous solution using bone char: DFT calculations and multicomponent experimental studies	68
Investigate the dynamic compressive (cushioning) response of 3D GFRP composites when the STF matrix base material is modified PEG	67
Solvent free synthesis of carbon modified hexagonal boron nitride nanorods for the adsorptive removal of aqueous phase emerging pollutants	67
Machine learning analysis for the rheological mechanism of polysaccharide colloids	66
Multifunctional cationic pyridinium surfactants: molecular assemblies for drug solubilization and bioactive applications	66
Investigation of the phase behavior of an aqueous solution comprising anionic and cationic surfactant mixtures	66
Insight into molecular mechanism of human insulin encapsulation into the polyacrylic acid/deoxycholic acid-modified chitosan nanogel: An experimental and molecular dynamics investigation	66
Nanoscale observations of specific ion effects on the interactions between calcite and oil during ion tuned water flooding	66
Advanced machine learning-based modeling of interfacial tension in the crude oil-brine-diethyl ether system: Insights into the effects of temperature and salinity	66
Temperature-driven molecular aggregation and phase behavior in sec-butyl alcohol/water mixtures	65
Immobilization of chalcone chemosensor into plasma-pretreated recycled polyester fibers toward multi-stimuli responsive textiles for detection of ammonia	65
Molecular simulation on structural and molecular properties of polymer-blend nanoparticles	65
Density, critical point, and the structure of supercritical ethanol–water mixtures	65
Nano dance: Unraveling Ceria's self-assembly symphony	65
On the molecular mechanisms of H2/N2 uptake in confined ionic liquids: A computational study	65
Enhancing electrolyte performance: A DFT study of ethanol-enhanced 1-butyl-3-methylimidazolium tetrafluoroborate complex systems adsorption on graphene surface	65
Radiolytic degradation of β-lactam and tetracycline antibiotics in the presence of protein	65
The hydration effect on hydrogen bond strength in the second coordination sphere of ethylenediamine and glycine metal complexes	65
Oil detachment enhancement from rough calcite using silica/titania nanocomposite: Molecular dynamics simulation approach	65
Nutraceutical formulated oil-in-water emulsion: Synthesis, characterization and biological applications	65
Thermophysical behavior of hydroprocessed esters and fatty acids from wastewater sludge enriched with glycol ethers	65
Induced re-entrant SmA phase in binary mixtures of lactic acid derivatives	64
High efficiency dye adsorption and oil–water separation of aminated-SiO2 decorated monolayer Ti3C2Tx MXene	64
Hydrophobic solvation and liquid water: A theoretical investigation using thermodynamic perturbation and integral equations theory	64
Pluronics® based Penta block copolymer micelles as a precursor of smart aggregates for various applications: A review	64
Local field and deformation of droplets in emulsions	64
Molecular basis of the activity of a photoswitchable histone deacetylase inhibitor	64
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	63
A critical review of main enhanced oil recovery mechanisms by considering recent applications of green and novel nanocomposites	63
Next-generation biodegradable ionic liquids based on DNA nucleotide and amino acids: MM/QM/MD design, synthesis, and characterization	63
Inhibition of human epidermal growth factor receptor-2 protein by some alkaloid inhibitors	62
Mechanisms of surfactant improving water injection huff and puff efficiency in tight reservoir	62
Griseofulvin in aqueous solutions of deep eutectic solvents based urea and polyethylene glycol: Solubility and density measurements	62
Water jumps over a nanogap between two disjoint carbon nanotubes assisted by thermal fluctuation	62
Exploring the molecular basis of tucatinib interaction with human serum albumin: A spectroscopic and computational analysis	61
Molecular insights into water adsorption-desorption in MOF-801: A parametric study via GCMC and MD simulations	61
Molecular simulation and experimental validation for surface tension of new Low-GWP refrigerant mixtures R32/CF3I and R1123/CF3I	61
Surface-modified silica nanoparticles for enhanced oil recovery in sandstone cores	61
Thione tautomer of hydrazone-carbodithioate chelator-derived Cu(II) and Zn(II) complexes as potential antibacterial agents: DFT computations and UV-assisted photocatalytic degradation of Rose Bengal d	61
Enhancing solubility of organic crystalline ingredients in aqueous phase through preferential spatial association with polyols	60
Thermophysical properties of binary mixtures of diethyl ether as oxygenate with cyclohexane and aromatic hydrocarbons	60
Evaluation of tamoxifen analogues as potential estrogen receptor alpha inhibitors for breast cancer treatment: A computational approach	60
Spectroscopic and computational study of molecular interaction of Pexidartinib with homologous mammalian transport proteins	60
Enhanced dispersion of graphene sheets in various liquid solvents supported by poly(ionic liquid) via non-covalent interaction	59
Silver nanoparticles modified titanium carbide MXene composite for RSM-CCD optimised chloride removal from water	59
Difference in aqueous solution structure at 293.2 and 473.2 K between ethanol and ethylene glycol via molecular dynamics	59
Promoting dissolution behaviors of low-carbon alcohol polyoxyethylene polyoxypropylene ether in CO2 by molecular structure optimization and adding cosolvent	59
Coordination reaction triggered xanthan gum and Fe(III) self-assembly and adsorption on hematite surface for quartz-hematite flotation separation	58
Predicting viscosity of ionic liquids - water mixtures by bridging UNIFAC modeling with interpretable machine learning	58
Atranorin is a novel potential candidate drug for treating myelodysplastic syndrome	58
One-pot synthesized multifunctional carbon nitride dots for fluorescent sensing, bioimaging, and selective cytotoxic effect on cancer cells	58
Cu-trimesic acid-based metal organic frameworks for improved ß-galactosidase immobilization: Enhanced stability, reusability and lactose hydrolysis	58
Tribological behavior of two novel choline acetate-based deep eutectic solvents	58
The decisive role of filtration reducers’ surface charge in affecting drilling fluid filtration performance	58
Comparative study on ethosomes and transferosomes for enhancing skin permeability of sinapic acid	57

Effects of variable thermal conductivity and curvature parameter on the peristalsis of hybrid nanofluid through a curved channel with curvature dependent channel walls	57
Interfacial behavior and emulsion stability of lipid delivery system regulated by two-dimensional facial amphiphiles bile salts	57
Experimental and molecular dynamics studies of the effect of electrolytes on the interaction and energetics of the mixture of triton X-100 + metformin hydrochloride	57
Artificial intelligent approach for flow stability in Eyring Powell hybrid nanofluids via porous shrinking sheets	57
Hydrophobic eutectic solvents for sustainable recovery of carotenoids from mango peel: Extraction optimization and insights into molecular interactions at play	57
Effects of hydrogen-bonding functional groups of ammonium based-ionic liquids with Tf2N anion on the upper critical solution temperature in aqueous solutions	57
Thermodynamic analysis and molecular dynamic simulation of the solubility of risperidone (form I) in the pure and binary solvents	57
Polymer-stabilized blue phase liquid crystal devices with ultra-low hysteresis and driving stability	57
Facile synthesis of copper oxide nanoparticles (CuONPs) using green method to promote photocatalytic and biocidal applications	57
Comparative study on encapsulation of four different flavonoids into pea protein isolate nanoparticles: The impact of glycosylation	57
Aqueous dispersions of highly conductive carbon nanomaterials: Unusual aggregation mechanism	57
The effect of alkyl chain on the corrosion inhibition of benzyldimethylammonium chloride in acidic environments	56
Anions mediated electron-rich metalloporphyrin ionic framework as recyclable catalyst for conversion of urea into cyclic carbonates	56
H – Bond interactions in water multimers and water multimers – Pyridine complexes: Natural bond orbital and reduced density gradient isosurface analyses	56
Experimental and theoretical study of the Favipiravir association in water solvent	56
Solubilization and remediation of polycyclic aromatic hydrocarbons in groundwater by cationic surfactants coupled nanobubbles: Synergistic mechanism and application	56
Essential oil of Dysphania ambrosioides as a green corrosion inhibitor for mild steel in HCl solution	56
Efficient and selective extraction of gold from acidic leaching solutions using novel guanidinium ionic liquid	56
Effect of mixed surfactants on foam stabilization: A molecular dynamics simulation	56
Anti-inflammatory drug diclofenac removal by a synthesized MgAl layered double hydroxide	56
Achieving accurate entropy and melting point by ab initio molecular dynamics and zentropy theory: Application to fluoride and chloride molten salts	56
The role of NH	56
Highly furosemide uptake employing magnetic graphene oxide: DFT modeling combined to experimental approach	56
Study on OH radical oxidation of 4H-SiC in plasma based on ReaxFF molecular dynamics simulation	55
Chromo-fluorogenic detection of Sarin, Tabun, and mustard gas mimics triggering the ring-opening reaction in a spirolactam-based probe	55
Electronic effect of X = S- and O-atoms in iron(II) thiophenyl/furyl imino-complexes in DNA interaction, biological features, and catalytic oxidative action of 1,2-cyclohexene	55
Modeling viscosity of SiO2-Al2O3-CaO based slags using Arrhenius and VFT models as well as the CALPHAD method	55
Acylhydrazone-functionalized triphenylamine V-shaped liquid crystals: Synthesis, columnar self-assembly, gel property and application for the detection of Cu2+	55
Scale inhibition mechanism of itaconic acid-sodium methacrylate sulfonate on calcite: Quantum chemical calculation and molecular dynamics simulation	54
Effect of different salt ions with different concentrations on the stability of carbon dioxide-in-water foam fracturing fluids	54
Herbal approach for treatment of cancer using curcumin as an anticancer agent: A review on novel drug delivery systems	54
Synthesis and performance of piperidinium-based ionic liquids as catalyst for biomass conversion into 3-acetamido-5-acetylfuran	54
Insight into intermolecular interactions in ethyl acetate + alkyl acrylate binary systems at different temperatures by means of volumetric, ultrasonic, viscometric and optical properties: Experimental	54
Removal of phenolic compounds from aqueous solution using Hydrophobic deep eutectic Solvent: Liquid-Liquid phase behavior and intermolecular interactions	54
Extraction of flavonoids from Butterfly blue pea (Clitoria ternatea) flower as carbon steel corrosion inhibitor in CO2 environment: Experimental and theoretical approaches	54
A physical picture of liquid–liquid phase separation of proteins	54
Experimental and theoretical study of 2-mercaptopyridine as an effective eco-friendly inhibitor for copper in aqueous NaCl	54
Optimizing parameters to improve PDMS surface wettability and the thermal conductivity analysis	53
Mechanistic exploration of Perfluorooctanoic Acid-Induced Hen egg white lysozyme aggregation at physiological Conditions: Spectroscopic and thermodynamic insights	53
Surface-functionalized nanoparticles for targeted drug delivery across the blood-brain barrier: advances and challenges in neurodegenerative disease therapy	53
Synthesis of Adenosine 5-monophosphate monohydrate functionalized mesoporous Ag/CuO/MCM-41 nanostructures for enormous mineralization of insistent organic contaminants and photoinhibition of bacteria	53
Mechanisms of electric field-induced interactions between nanodroplets transmitted through a graphene monolayer	53
Extraction of flavonoids from Glycyrrhiza residues using deep eutectic solvents and its molecular mechanism	53
Corrosion inhibition of mild steel in 1 M HCl using 4-chlorothiobenzamide: Molecular and computational insights	53
Squaric acid driven supramolecular metallogels of Cd(II) and Zn(II): Sensitive inhibitors for multi-drug resistance ESKAPE pathogens	52
Catalytic reduction of toxins with metal nanoparticles fabricated in microgels and sodium borohydride: A comprehensive review	52
Chemically reactive MHD convective flow and heat transfer performance of ternary hybrid nanofluid past a curved stretching sheet	52
Cellulose nanoproducts isolated from lignocellulosic materials using DES-like mixtures – A minireview: State-of-the-art 2023	52
The adsorption of p-hydroxybenzoic acid on graphene oxide under different pH and in-situ desorption in direct current electric field	52
Molecular dynamics study of the influence of water molecular phase state on the replacement of CO2–CH4 hydrate in porous media	52
An environmentally friendly photocatalyst for the breakdown of RhB, MB, 2,4-DCP, and TCAA: Reusable Fe3O4/Ag doped g-C3N4	52
Determination of density, dynamic viscosity, surface tension, and refractive index of thymol-based hydrophobic eutectic solvents with analysis of their correlated properties	52
A novel self-degradable gel (SDG) as liquid temporary plugging agent for high-temperature reservoirs	52
Growing nanoparticles to assemble a modern three-dimensional nanoarchitecture of Pt-Ru aerogel for advanced electrocatalysis	52
Carbon dioxide interaction with a series of ionic liquids consisting of fluorophenyltrifluoroborate anions studied by in situ ATR-FTIR spectroscopy	52
Aldose reductase inhibition properties of novel thiazolidin-2,4-diones: In vitro and in silico approach for the treatment of diabetes-related complications	52
The PEGylated and non-PEGylated interaction of the anticancer drug 5-fluorouracil with paramagnetic Fe3O4 nanoparticles as drug carrier	51
Synthesis, exploring the structural, non covalent interaction effects, biological assessment, molecular docking and quantum chemical properties of functionalized new N-nitrosopiperidin-4-one: An exper	51
Preparation, physicochemical analyses, and comparative evaluation studies of deep eutectic solvents (DES) from non-conventional precursor materials applied as catalytic curing agents for epoxy resin	51
Structure-dependent intermolecular interactions in benzaldehyde/cinnamaldehyde –chlorophenol–hexane ternary liquids: An integrated FTIR and thermoacoustic properties investigation	51
Synthesis and application of merrifield resin based supported ionic liquids as organocatalyst for the greener synthesis of bio-active triazoles	51
Database of deep eutectic solvents and their physical properties: A review	51
Synthesis investigation and exploring of new tetraglycidyl bisurea bisphenyl S polyepoxide as an excellent corrosion inhibitory resin for mild steel in 1M HCl environment: Comprehensive approaches	51
Ionic liquid-mediated drug delivery: A review on progress and challenges focused on poly(ionic liquid) nanoplatforms	51
Thermodynamic study of binary mixtures of propilophenone + 2-propanol, 2-butanol, 2-pentanol, or 2-hexanol at temperatures of 293.15 to 323.15 K: Modeling by Prigogine-Flory-Patterson theory	51
Studying the effect of various types of chemical reactions on hydrodynamic properties of dispersion and peristaltic flow of couple-stress fluid: Comprehensive examination	51
CuCo2O4/CeO2 S-scheme photocatalyst for promoted CO2 photoreduction to CH3OH	51
Keys to enhancing efficiency in nanoparticle-based foam EOR: Experimental insights into different types of surfactant-nanoparticle interactions	51
A CO2-responsive Janus SiO2 nanofluid: Integration of enhanced oil recovery and demulsification	51
Interaction mechanism of soy protein isolate with aldehyde flavor compounds: Differences in carbon chain length and unsaturation	51
Amino acid-based ionic liquids as water-ethylene glycol additives towards superior lubricity and corrosion resistance	50
Investigation the binding and partition properties of azithromycin drug using drug-surfactant mixed micelles in the presence of trisodium citrate electrolyte	50
Dynamic light scattering for the determination of linoleic acid critical micelle concentration. Effect of pH, ionic strength, and ethanol	50
The use of carboxylated graphene oxides and related materials for the adsorption of metals and dyes: A review	50
Investigating the potential of eutectic gel-formed composites in developing energy-efficient windows	50
COSMO-RS prediction, experimental investigation, and mechanism analysis: A new approach to separating the n-hexane - tert-butanol azeotropic system via liquid-liquid extraction with ionic liquids	50
Evaluation and correlation of self-healing functionalized silane-based hybrid nanocomposite materials as corrosion inhibitor	50
Novel insights into graphene oxide-based adsorbents for remediation of hazardous pollutants from aqueous solutions: A comprehensive review	50
Biperiden Hydrochloride/β -Cyclodextrins supramolecular system and its cytotoxicity against lung adenocarcinoma cells	50
Integrating experimental and first-principles calculations to evaluate Gleditsiae Sinensis Fructus extract as an eco-friendly corrosion inhibitor for Q235 steel in acidic environment	50
Study of the effect of high-temperature activation of quartz on the adsorption of gold cyanide	49
Binary dyes adsorption onto novel designed magnetic clay-biopolymer hydrogel involves characterization and adsorption performance: Kinetic, equilibrium, thermodynamic, and adsorption mechanism	49
1,3-Propanediol extraction from aqueous phase using hydrophobic eutectic solvents: Insights from experiments and molecular dynamics simulations	49
Insight into selective depression of sodium thioglycallate on arsenopyrite flotation: Adsorption mechanism and constructure	49
Coalescence behavior of fully submerged CO2 nanobubbles: A molecular dynamics based parametric study	49
In situ gelling microemulsion for topical ocular delivery of moxifloxacin and betamethasone	49
Thermophysical characterization on water and ethylene glycol/water-based MgO and ZnO nanofluids at elevated temperatures: An experimental investigation	49
Molecular dynamic investigation on the thermophysical properties of binary molten carbonate mixtures	49
Synthesis and characterization of new imidazolium based protic ionic liquids obtained by nitro- and cyano-functionalization	49
Highly efficient removal of endocrine disrupting pesticides by metal ferrites loaded Guar gum based green nanomaterials	49
Surface engineered Nanofluids in geothermal systems: Experimental evaluation of enhancement in chemical and thermal stability of Nanofluids and numerical investigation of the effect of nanoparticles i	48
α-Amylase inhibition, anti-glycation property and characterization of the binding interaction of citric acid with α-amylase using multiple spectroscopic, kinetics and molecular docking approaches	48
Adsorption behavior and corrosion inhibition performance of tetrazolium derivatives on electrolytic copper foil surface	48
Columnar mesomorphism in molecular alloys based on Halogen-Bridged PtII/PtIV mixed valence complexes. The key role of the PtII/PtIV ratio	48
On the hydrolysis of iron ions: DFT-based molecular dynamics perspective	48