Journal of Molecular Liquids

Article	Citations
Experimental and theoretical study of the Favipiravir association in water solvent	606
Synergistic and antagonistic effects during solvent extraction of Gd(III) ion in ionic liquids	423
Effect of different salt ions with different concentrations on the stability of carbon dioxide-in-water foam fracturing fluids	385
Ionic complexes in liquid Li–K–Pb alloys	278
Molecular dynamic simulations on wetting transition of nanofluid on a single grooved structure	265
Filtration and structure of bentonite-β-cyclodextrin polymer microspheres suspensions: Effect of thermal aging time	247
Improved performance of CNT-Pd modified Cu2O supported on Nickel foam for hydrogen evolution reaction in basic media	241
Deconstruction of technical grade diglycerol isostearate enables the controlled preparation of hexosomes and liposomes	241
Immunoinformatics based designing and simulation of multi-epitope vaccine against multi-drug resistant Stenotrophomonas maltophilia	223
Reply to “Comments on ‘Solubility and thermodynamic properties of an energetic intermediate in four binary solvents (water + n-butanol, n-pentanol, isobutanol and isoamyl alcohol)’”	217
Editorial Board	215
Neutral polymer-pseudo polyelectrolyte transition of a post irradiated polymer dissolved in water	200
Editorial Board	184
Study for removing of silica nanoparticle in pure isopropyl alcohol with a cation exchange membrane	178
Activation induced fluidization of a confined viscous liquid	167
Evaluation and correlation of self-healing functionalized silane-based hybrid nanocomposite materials as corrosion inhibitor	164
Editorial Board	140
Molecular insights into the compression response of nitrogen/tetrafluoromethane liquid mixture from ab initio molecular dynamics	138
Investigation of micellization and thermodynamic properties of cationic gemini surfactant (12-2-O-2-12) in the presence of organic solvents	137
Retention characteristics, saturated vapor pressure and vaporization enthalpy of mesityl oxide ethers of linear alcohols C1–C5	137
Immobilization of chalcone chemosensor into plasma-pretreated recycled polyester fibers toward multi-stimuli responsive textiles for detection of ammonia	137
Rheology of high-temperature resistant fracturing fluids formed by VES, acids and oxidants for enhancing CO2 injection in deep coal seams	135
Alkali halide force fields: Utilizing the melting temperature	134
Inhibition of human epidermal growth factor receptor-2 protein by some alkaloid inhibitors	133
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.	133

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	128
Prediction of the adsorption properties of liquid at solid surfaces with molecular scale surface roughness via encoding-decoding convolutional neural networks	127
Complex formation of Zinc(II) ion with acetonitrile in ionic liquid [C2mim][TFSA] studied by 15N NMR spectroscopy and DFT calculation	127
Preparation and characterization of oxidized graphene for actinides and rare earth elements removal in nitric acid solutions from nuclear wastes	127
Phase equilibria and interfacial properties of selected methane + n-alkane binary mixtures	126
Co-loading of doxorubicin and anti-cancer peptide LL-37 on covalently functionalized carbon nanotubes; a molecular dynamics simulation study	125
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)	124
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	123
Unlocking the power of resonance Raman spectroscopy: The case of amides in aqueous solution	122
Study on adsorption behaviors of different cresols: First-principles calculation	122
Parallel (competitive) reactions of micelle formation and cyclodextrin–surfactant inclusion complex formation in aqueous solution: A consequence of the Gibbs–Duhem equation—invariance of the mass acti	120
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	120
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)	118
Descriptors for vitamin K3 (menadione); calculation of biological and physicochemical properties	117
Editorial Board	114
Experimental and theoretical investigation of water sorption on lemon leaves: New perspectives with statistical physical modeling	114
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	113
Solubilization and remediation of polycyclic aromatic hydrocarbons in groundwater by cationic surfactants coupled nanobubbles: Synergistic mechanism and application	111
Carbon dioxide interaction with a series of ionic liquids consisting of fluorophenyltrifluoroborate anions studied by in situ ATR-FTIR spectroscopy	110
Self-assembly and phase transition of gold nanoclusters in natural deep eutectic solvent for visual detection of toxicants in water environment	110
Catalytic reduction of toxins with metal nanoparticles fabricated in microgels and sodium borohydride: A comprehensive review	109
On the path to aqueous organic redox flow batteries: Alizarin red S alkaline negolyte. Performance evaluation and photochemical studies	109
Perspective on the passivity of Ti6Al4V alloy in H2SO4 and NaOH solutions	108
Verification of corrosion inhibition of Mild steel by some 4-Aminoantipyrine-based Schiff bases – Impact of adsorbate substituent and cross-conjugation	107
Photophysics of a cyanine dye in the protein-surfactant aggregates	106
Probing host guest inclusion complex and its applications by biophysical approach subsequently optimized by molecular docking	105
Novel and green hydroxyperylene imide based fluorescent polymer for calcium sulfate scale inhibition	105
Utilizing different machine learning methods to accurately predict density, temperature, velocity, and thermal conductivity of hydrophilic, hydrophobic, and compound materials	104
Mechanisms of electric field-induced interactions between nanodroplets transmitted through a graphene monolayer	102
SAFT-γ force field for the simulation of molecular fluids 9: Coarse-grained	102
Understanding ion–ion and ion–solvent interactions in aqueous solutions of morpholinium ionic liquids with N-acetyl-L-alaninate anion through partial molar properties and molecular dynamics simulation	100
Topological descriptors and Laplace spectra in simple hydrogen bonded systems	100
Multiwavelength spectrophotometric-thermodynamic studies of complexation reactions of newly synthesized triazenes with Hg2+, Pb2+, Zn2+, and Cd2+ in MeOH, EtOH, DMF, and DMSO	100
Insight into molecular mechanism of human insulin encapsulation into the polyacrylic acid/deoxycholic acid-modified chitosan nanogel: An experimental and molecular dynamics investigation	99
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	98
Molecular modeling and molecular dynamics investigations of water mediated diffusion of biogenic nanosilica into plant leaf’s epicuticular wax layer	98
1,3-Propanediol extraction from aqueous phase using hydrophobic eutectic solvents: Insights from experiments and molecular dynamics simulations	98
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	97
Machine learning analysis for the rheological mechanism of polysaccharide colloids	95
Double-Brønsted acidic deep eutectic solvents and their applications as solvents and catalysts in chemical transformations	94
Two shear driven flow regimes in microfluidic nematic devices: Tumbling and laminar	93
Molecular dynamics study on bubble nucleation characteristics on rectangular Nano-Grooved surfaces	93
A physical picture of liquid–liquid phase separation of proteins	93
Synthesis and application of merrifield resin based supported ionic liquids as organocatalyst for the greener synthesis of bio-active triazoles	93
Spontaneous spreading of nanodroplets on partially wetting surfaces with continuous grooves: Synergy of imbibition and capillary condensation	92
A cytostatic drug from the class of triazine derivatives: Its properties in aqueous solutions, cytotoxicity, and therapeutic activity	92
The adsorption of p-hydroxybenzoic acid on graphene oxide under different pH and in-situ desorption in direct current electric field	90
A systematic molecular investigation on Sodium Dodecyl Benzene Sulphonate (SDBS) as a Low Dosage Hydrate Inhibitor (LDHI) and the role of Benzene Ring in the structure	89
Molecular insights into complex formation between scandenin and various types of β-cyclodextrin	89
Physicochemical properties of ionic liquids with indole removal function	89

Structural modulation of heterometallic metal–organic framework via a facile metal-ion-assisted surface etching and structural transformation	87
Promoting dissolution behaviors of low-carbon alcohol polyoxyethylene polyoxypropylene ether in CO2 by molecular structure optimization and adding cosolvent	86
Lorentz forces induced by a static magnetic field have negligible effects on results from classical molecular dynamics simulations of aqueous solutions	86
Study on a Two-dimensional nanomaterial reinforced wormlike micellar system	85
Molecular simulation and experimental validation for surface tension of new Low-GWP refrigerant mixtures R32/CF3I and R1123/CF3I	85
Research on dissolution of actarit in aqueous mixtures: Solubility determination and correlation, preferential solvation, solvent effect and thermodynamics	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
Rheology, viscoelasticity and microstructural properties of OAPB-SDS mixtures at different temperature and pH conditions	85
Hansen solubility parameters and green nanocarrier based removal of trimethoprim from contaminated aqueous solution	85
Potential energy surfaces of antiparallel water-water interactions	83
Evaluation of the influence of surface structure on tribological properties of the solid–liquid interface: Analytical and experimental assessment	83
Spectroscopic and computational study of molecular interaction of Pexidartinib with homologous mammalian transport proteins	83
Simulation study of solvent effect on competitive degradation of aggregation of homo- and hetero- amyloid-β dimers	83
Acylhydrazone-functionalized triphenylamine V-shaped liquid crystals: Synthesis, columnar self-assembly, gel property and application for the detection of Cu2+	83
A 3D-RISM-KH study of liquid nitromethane, nitroethane, and nitrobenzene as solvents	82
Photoinduced emissive naphthalenediimide radical anion in the confinement of cucurbituril nanocavity; in situ generation of gold nanoparticles	82
Synthesis of carboxyl group functionalized polyhedral oligomeric silsesquioxane for fabricating ultrastable foams driven by high temperature and salinity	82
Exceptional dual fluorescent, excited-state intramolecular proton-transfer (ESIPT) columnar liquid crystals characterized by J-stacking and large Stokes shifts	82
Full relaxation dynamics recovery from ultrafast fluorescence experiments by means of the stochastic model: Does the solvent response dynamics depend on the fluorophore nature?	81
Modification of local and collective dynamics of water in perchlorate solution, induced by pressure and concentration	81
Concentration-driven selective adsorption of Congo red in binary dyes solution using polyacrolein: Experiments, characterization and mechanism studies	81
Efficient and selective extraction of gold from acidic leaching solutions using novel guanidinium ionic liquid	80
Construction and modulation of dual responsive AIE supramolecular aggregates combined with quantum chemistry simulation	80
Investigating the potential of eutectic gel-formed composites in developing energy-efficient windows	80
Effects of hydrogen-bonding functional groups of ammonium based-ionic liquids with Tf2N anion on the upper critical solution temperature in aqueous solutions	79
DFT study of difluoro & trifluoro bi-cyclohexane based dimer for application in electronic and optical devices	79
Anions mediated electron-rich metalloporphyrin ionic framework as recyclable catalyst for conversion of urea into cyclic carbonates	79
Atranorin is a novel potential candidate drug for treating myelodysplastic syndrome	78
Liquid-liquid equilibria for (polypropylene glycol 400 based magnetic ionic liquids + inorganic salts) aqueous two-phase systems at 298.15 K	78
Monte Carlo simulation for the effect of chain stiffness on the free surface of polymer melts	78
Photophysical study on synthesized triazolium ionic liquids and their stabilizing effect on native state of serum albumin	78
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	77
Biperiden Hydrochloride/β -Cyclodextrins supramolecular system and its cytotoxicity against lung adenocarcinoma cells	77
Electrochemical, thermodynamic, and physical properties of tetradecyltrihexylphosphonium ([P6,6, 6,14]+) and methyl-propyl piperidinium containing ionic liquids and their propylene carbonate solutions	77
Evaluation of tamoxifen analogues as potential estrogen receptor alpha inhibitors for breast cancer treatment: A computational approach	77
Difference in aqueous solution structure at 293.2 and 473.2 K between ethanol and ethylene glycol via molecular dynamics	77
Encapsulation of the quercetin with interpolyelectrolyte complex based on pillar[5]arenes	77
Synthesis and characterization of new imidazolium based protic ionic liquids obtained by nitro- and cyano-functionalization	76
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	76
Investigating the Age-Dependent behavior of MoS2-hBN nanohybrid additives on the rheological properties of diesel engine oil	76
Tuning the CO2 absorption and physicochemical properties of K+ chelated dual functional ionic liquids by changing the structure of primary alkanolamine ligands	76
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	76
Calculation of the formation enthalpies of charge-transfer complexes with iodine from the binding constants at 298.15 K	76
Molecular dynamics simulation of explosive boiling of the H2O-Cu nanofluid	75
Entropy-driven conformational transition of flexible Z-DNA to a novel non-B helix by double-methylated guanosine	75
Water jumps over a nanogap between two disjoint carbon nanotubes assisted by thermal fluctuation	75
Investigation of polymer−surfactant complexes by both micellar solubilization and pre-column derivatization capillary electrophoresis	75
On the molecular mechanisms of H2/N2 uptake in confined ionic liquids: A computational study	75
Pristine and ferroelectric liquid crystal dispersed four ring bent core nematic: Impact of dispersion on electro-optic and dielectric properties	75
Synthesis and mesomorphism of 3,4-dialkoxyphenylpyridine complexes of silver(I)	74
The decisive role of filtration reducers’ surface charge in affecting drilling fluid filtration performance	74
Study of the effect of high-temperature activation of quartz on the adsorption of gold cyanide	74
Molecular interactional study of SDS and CTAB in aqueous medium of anti-HIV drugs (Emtricitabine and Lamivudine) at different temperatures: A physicochemical investigation	73
The use of carboxylated graphene oxides and related materials for the adsorption of metals and dyes: A review	73
Self-assembly modulation in star block copolymers by amphiphilic diol: A scattering insight	73
Traction behavior and mechanism of molecular level with effects of molecular structure and sliding velocity in boundary lubrication regime: A molecular dynamics study	73
Poly(tannic acid)-functionalized onion-like carbon nanoparticles derived from candle soot serving as potent lubricant additives	73
Unraveling the thermodynamics, enzyme activity and denaturation studies of Triprolidine hydrochloride binding with model transport protein	73
A new magnetically separable zwitterionic copolymer hydrogel: Synthesis, characterization, and adsorption studies	72
Atomistic insights and tribological verification of partitioned functionalized graphene oxide dispersion properties	72
Mechanistic exploration of Perfluorooctanoic Acid-Induced Hen egg white lysozyme aggregation at physiological Conditions: Spectroscopic and thermodynamic insights	72
Solubilization of fullerene in polyoxyethylene tetradecyl ether type nonionic surfactants	72
Cellulose nanoproducts isolated from lignocellulosic materials using DES-like mixtures – A minireview: State-of-the-art 2023	71
Exploring the molecular basis of tucatinib interaction with human serum albumin: A spectroscopic and computational analysis	71
Highly furosemide uptake employing magnetic graphene oxide: DFT modeling combined to experimental approach	70
Non-covalent interactions in small thiophene clusters	70
Fluctuation in diethylene glycol diethyl ether/water mixtures near the lower critical solution temperature studied by small- and wide-angle x-ray scattering and thermodynamic calculation	69
Solvent free synthesis of carbon modified hexagonal boron nitride nanorods for the adsorptive removal of aqueous phase emerging pollutants	69
Probing the impact of bismuth-titanate based nanocomposite on the dielectric and electro-optical features of a nematic liquid crystal material	69
Thermophysical properties of binary mixtures of diethyl ether as oxygenate with cyclohexane and aromatic hydrocarbons	69
Revealing the role of hydrogen bonding interactions and supramolecular complexes in lignin dissolution by deep eutectic solvents	69
Modeling viscosity of SiO2-Al2O3-CaO based slags using Arrhenius and VFT models as well as the CALPHAD method	69
Role of L-arginine on the formation and breakdown of passive film onto the steel rebars surface in chloride contaminated concrete pore solution	69
Polymer-stabilized blue phase liquid crystal devices with ultra-low hysteresis and driving stability	69
Mechanisms of surfactant improving water injection huff and puff efficiency in tight reservoir	69
Integrated modeling, surface, electrochemical, and biocidal investigations of novel benzothiazoles as corrosion inhibitors for shale formation well stimulation	68
Biotin-functionalized silica nanoparticles loaded with Erythrosine B asselective photodynamic treatment for Glioblastoma Multiforme	68
Influence of sodium bis(2-ethylhexyl) sulfosuccinate on the self-assembly of AOT based surface-active ionic liquids having different pharmacologically active cations in the aqueous medium	68
Solubility of sildenafil citrate in 1-propanol + water mixtures at different temperatures	68
Atomistic insights into heat transfer and flow behaviors of nanofluids in nanochannels	68

Prediction of sulfonamides’ solubilities in the mixed solvents using solvation parameters	67
Comprehensive thermodynamic modeling framework for the estimation of physico-chemical properties of deep eutectic solvent-heavy crude oil system	67
Unravelling the non-covalent interactions in certain n-propyl amine – Ether systems through acoustic and DFT studies at 303.15 K	67
Influence of salts on the surface behavior of α-chymotrypsinogen A in aqueous solutions at 298.15 K	67
The solubilization of naphthalene using tea saponin as a biosurfactant: Effect of temperature	66
Evodiamine in several binary aqueous co-solvents: Solubility measurement and modeling, Hansen solubility parameter, preferential solvation and apparent dissolution and transfer properties	66
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	66
Quantum chemical exploration on the inhibition performance of indole and some of its derivatives against copper corrosion	66
Molecular dynamics study of electrocoalescence of pure water and salty nanodroplets	66
Mixtures of cationic guar gum and anionic surfactants as stabilizers of zirconia suspensions	65
Thermophysical characterization on water and ethylene glycol/water-based MgO and ZnO nanofluids at elevated temperatures: An experimental investigation	65
Effect of hydroxyl group on foam features of hydroxyl-based anionic ionic liquid surfactant: Experimental and theoretical studies	64
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	64
Nanoscale observations of specific ion effects on the interactions between calcite and oil during ion tuned water flooding	64
Thermodynamic study of interaction effects in aqueous solutions of purine and pyrimidine nucleobases ionic liquids at 298.15 K	64
Prediction of hypothetical solubility of drugs in phase separated miscible binary solvent mixtures using an interpolation technique	64
Thermodynamic analysis and molecular dynamic simulation of the solubility of risperidone (form I) in the pure and binary solvents	64
Influence of water penetration on glass fiber-epoxy resin interface under electric field: A DFT and molecular dynamics study	63
Synthesis, characterization, toxicity evaluation and inhibitory effect of hesperitin-copper (Ⅱ) complex on xanthine oxidase	63
Inhibition of mild steel corrosion in 1 M H2SO4 by a gemini surfactant 1,6-hexyldiyl-bis-(dimethyldodecylammonium bromide): ANN, RSM predictive modeling, quantum chemical and MD simulation studies	63
Advanced machine learning-based modeling of interfacial tension in the crude oil-brine-diethyl ether system: Insights into the effects of temperature and salinity	63
Influence of the cation partner on levulinate ionic liquids properties	63
Advances in the rheology of emulsion explosive	63
Thermodynamics of the L-tryptophan interaction with glycerol or urea in water at ambient conditions	63
The effect of alkyl chain on the corrosion inhibition of benzyldimethylammonium chloride in acidic environments	63
The PEGylated and non-PEGylated interaction of the anticancer drug 5-fluorouracil with paramagnetic Fe3O4 nanoparticles as drug carrier	63
Recent advances in essential oils-based metal nanoparticles: A review on recent developments and biopharmaceutical applications	63
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	62
DNA mediated graphene oxide (GO)-nanosheets dispersed supramolecular GO-DNA hydrogel: An efficient soft-milieu for simplistic synthesis of Ag-NPs@GO-DNA and Gram + ve/-ve bacteria-based Ag-NPs@GO-DNA-	62
A CO2-responsive Janus SiO2 nanofluid: Integration of enhanced oil recovery and demulsification	62
Layer structure of quaternary-ammonium-salt-type amphiphilic gemini and trimeric ionic liquids	62
Predicting viscosity of ionic liquids - water mixtures by bridging UNIFAC modeling with interpretable machine learning	61
Investigation the binding and partition properties of azithromycin drug using drug-surfactant mixed micelles in the presence of trisodium citrate electrolyte	61
One-pot synthesized multifunctional carbon nitride dots for fluorescent sensing, bioimaging, and selective cytotoxic effect on cancer cells	61
Squaric acid driven supramolecular metallogels of Cd(II) and Zn(II): Sensitive inhibitors for multi-drug resistance ESKAPE pathogens	61
Facile synthesis of copper oxide nanoparticles (CuONPs) using green method to promote photocatalytic and biocidal applications	61
Development of poly-L-lysine multi-functionalized muco-penetrating self- emulsifying drug delivery system (SEDDS) for improved solubilization and targeted delivery of ciprofloxacin against intracellul	61
Interfacial behavior and emulsion stability of lipid delivery system regulated by two-dimensional facial amphiphiles bile salts	61
Ionic liquid-mediated drug delivery: A review on progress and challenges focused on poly(ionic liquid) nanoplatforms	61
Nutraceutical formulated oil-in-water emulsion: Synthesis, characterization and biological applications	61
Recent advances in adsorptive removal and catalytic reduction of hexavalent chromium by metal–organic frameworks composites	61
Study on OH radical oxidation of 4H-SiC in plasma based on ReaxFF molecular dynamics simulation	60
Radiolytic degradation of β-lactam and tetracycline antibiotics in the presence of protein	60
Synthesis of Adenosine 5-monophosphate monohydrate functionalized mesoporous Ag/CuO/MCM-41 nanostructures for enormous mineralization of insistent organic contaminants and photoinhibition of bacteria	60
Inhibition effect of N-propargyl saccharin as corrosion inhibitor of C38 steel in 1 M HCl, experimental and theoretical study	60
Removal of phenolic compounds from aqueous solution using Hydrophobic deep eutectic Solvent: Liquid-Liquid phase behavior and intermolecular interactions	60
Experimental and computational studies of the influence of non-ionic surfactants with coumarin moiety as corrosion inhibitors for carbon steel in 1.0 M HCl	60
Density functional theory study on biodiesel production from yeast lipid catalyzed by imidazolium ionic liquid	60
Coalescence behavior of fully submerged CO2 nanobubbles: A molecular dynamics based parametric study	60
Synthesis and performance of piperidinium-based ionic liquids as catalyst for biomass conversion into 3-acetamido-5-acetylfuran	59
Physical properties and reaction kinetics of CO2 absorption into unloaded and CO2 loaded viscous monoethanolamine (MEA) solution	59
Growing nanoparticles to assemble a modern three-dimensional nanoarchitecture of Pt-Ru aerogel for advanced electrocatalysis	59
A molecular dynamic insight into CO2 diffusion of type III porous liquids	59
Enhanced dispersion of graphene sheets in various liquid solvents supported by poly(ionic liquid) via non-covalent interaction	59
Keys to enhancing efficiency in nanoparticle-based foam EOR: Experimental insights into different types of surfactant-nanoparticle interactions	59
Linear hydrophobic congeneric groups of bile acid anion derivatives based on the self-association (micellization) process and the phenomenon of enthalpy–entropy compensation	59
Insight into selective depression of sodium thioglycallate on arsenopyrite flotation: Adsorption mechanism and constructure	59
Effect of external electric fields on sulfur dioxide–water systems	59
Artificial intelligent approach for flow stability in Eyring Powell hybrid nanofluids via porous shrinking sheets	59
Pluronics® based Penta block copolymer micelles as a precursor of smart aggregates for various applications: A review	58
Implementation of AdaBoost and genetic algorithm machine learning models in prediction of adsorption capacity of nanocomposite materials	58
Synthesis, solvatochromism and dipole moment in the ground and excited states of substitute phenol derivative fluorescent Schiff base compounds	58
Affinity and putative entrance mechanisms of alkyl sulfates into the β-CD cavity	58
Novel cationic Gemini ester surfactant as an efficient and eco-friendly corrosion inhibitor for carbon steel in HCl solution	58
Viscosity-driven stabilization of CO2-in-brine foams using mixtures of cocamidopropyl hydroxysultaine and sodium dodecyl sulfate	58
In situ gelling microemulsion for topical ocular delivery of moxifloxacin and betamethasone	58
Insight into the mechanism of asphaltene disaggregation by alkylated treatment: An experimental and theoretical investigation	58
Optimizing the efficient removal of ibuprofen from water environment by magnetic carbon aerogel: kinetics, isotherms, and thermodynamic studies	57
Extraction of flavonoids from Butterfly blue pea (Clitoria ternatea) flower as carbon steel corrosion inhibitor in CO2 environment: Experimental and theoretical approaches	57
Application of aluminum nitride nanotubes as a promising nanocarriers for anticancer drug 5-aminosalicylic acid in drug delivery system	57
Molecular simulation on structural and molecular properties of polymer-blend nanoparticles	57
Analysing the molecular interactions of ternary (lactose + water + tributylmethylammonium chloride) solutions at different temperatures via physicochemical methods	57
A comparative study for molecular insight on riparins (I–III) by quantum chemical, spectroscopic, and molecular docking methods	56
Molecular dynamics study on water confinement in deep eutectic solvents	56
Molecular simulation study of methane hydrate decomposition in the presence of hydrophilic and hydrophobic solid surfaces	56
H – Bond interactions in water multimers and water multimers – Pyridine complexes: Natural bond orbital and reduced density gradient isosurface analyses	56
A DFT-based study on CFBP: Structural, solvent spectroscopic analysis and ligand protein interaction with the antipsychotic characteristics	56
A novel self-degradable gel (SDG) as liquid temporary plugging agent for high-temperature reservoirs	56
Volumetric, transport and acoustic properties of binary mixtures containing alkanol at 298.15–318.15 K	56
Molecular dynamics study of the influence of water molecular phase state on the replacement of CO2–CH4 hydrate in porous media	56
An environmentally friendly photocatalyst for the breakdown of RhB, MB, 2,4-DCP, and TCAA: Reusable Fe3O4/Ag doped g-C3N4	56
Adsorption behavior and corrosion inhibition performance of tetrazolium derivatives on electrolytic copper foil surface	56
Visible light induced efficient photocatalytic degradation of azo dye into nontoxic byproducts by CdSe quantum dot conjugated nano graphene oxide	56
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	56
State-of-the-art ionic liquid & ionanofluids incorporated with advanced nanomaterials for solar energy applications	55
Vapor-liquid equilibrium for dimethyl ether and three imidazolium ionic liquids as working pairs in absorption-refrigeration cycle	55
Amino acid-based ionic liquids as water-ethylene glycol additives towards superior lubricity and corrosion resistance	55
Improving the separation of guaiacol from n-hexane by adding choline chloride to glycol extracting agents	55
Columnar mesomorphism in molecular alloys based on Halogen-Bridged PtII/PtIV mixed valence complexes. The key role of the PtII/PtIV ratio	55
Studying the effect of various types of chemical reactions on hydrodynamic properties of dispersion and peristaltic flow of couple-stress fluid: Comprehensive examination	55
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	55
Efficient uptake of NH3 by dual active sites NH4SCN-imidazole deep eutectic solvents with low viscosity	55
Molecular aggregation effect on the antagonistic adsorption of pharmaceuticals from aqueous solution using bone char: DFT calculations and multicomponent experimental studies	55
Evaluation of anti-corrosion performance of poly(maleic acid-co-N‐[3‐(dimethylamino)propyl]‐methacrylamide) as novel copolymer inhibitor for carbon steel in neutral medium	55
Thermophysical properties analysis of graphene-added phase change materials and evaluation of enhanced heat transfer effect in underwater thermal vehicles	55