Physical Chemistry Research

A

Ability of heating factor A Numerical Investigation of the Thermal Transport Properties of Argon + Hydrogen Plasma Working Gases in the Presence of Various TiO2 Precursor Solutions [Volume 11, Issue 4, 2023, Pages 897-912]
ACE2 Towards Screening and Repurposing of Approved Drugs for the Treatment of COVID-19 Using Molecular Docking [Volume 11, Issue 4, 2023, Pages 707-723]
Acrylamide Flocculation of Clay Suspensions Using Copolymers Based on Acrylamide and Biopolymer [Volume 11, Issue 2, 2023, Pages 221-230]
Activated carbon Bio-sorption of As(V) from Aqueous Solutions by Thuja Occidentalis Leaves Activated Carbon@Al Embedded Material [Volume 11, Issue 2, 2023, Pages 287-297]
Activated carbon Removal of Formaldehyde from Aqueous Solution Using Low-cost and Reusable Adsorbents [Volume 11, Issue 4, 2023, Pages 853-864]
ADME Discovery of New Inhibitors of Enoyl-ACP Reductase via Structure-Based Virtual Screening [Volume 11, Issue 3, 2023, Pages 459-469]
ADMET In-Silico Molecular Docking, Validation, Drug-Likeness, and ADMET Studies of Antiandrogens to Use in the Fight against SARS-CoV-2 [Volume 11, Issue 1, 2023, Pages 9-21]
ADME-Tox In Silico Approach for Designing Novel SARS-CoV-2 Inhibitors from Medicinal Plants [Volume 11, Issue 3, 2023, Pages 589-604]
Adsorbent Removal of Pb(II) Ion from Aqueous Solution Using As-synthesized CuO/Cu2O Nanocomposites [Volume 11, Issue 1, 2023, Pages 171-180]
Adsorption Optimization of Adsorption Process Parameters of Allura Red Removal Using Nanodiopside/Zn-Fe Layered Double Hydroxide Composite by Response Surface Methodology: A Kinetic, Thermodynamic, and Equilibrium Approach [Volume 11, Issue 1, 2023, Pages 63-78]
Adsorption Adsorption of an Azo Dye on Graphene Nanosheet: A Molecular Dynamics Simulation Study [Volume 11, Issue 1, 2023, Pages 117-127]
Adsorption Bio-sorption of As(V) from Aqueous Solutions by Thuja Occidentalis Leaves Activated Carbon@Al Embedded Material [Volume 11, Issue 2, 2023, Pages 287-297]
Adsorption RSM Optimized Adsorption of Eriochrome Black T Dye onto Alumina Nanoprticles: Isotherm and Kinetics Studies [Volume 11, Issue 2, 2023, Pages 315-326]
Adsorption Enhanced Removal of Brilliant Orange by Poly(4-vinylpyridine)/Acid-Activated Bentonite Composite [Volume 11, Issue 2, 2023, Pages 327-339]
Adsorption Removal of Formaldehyde from Aqueous Solution Using Low-cost and Reusable Adsorbents [Volume 11, Issue 4, 2023, Pages 853-864]
Adsorption Adsorption of Some Gas Molecules on the Surface of Graphene Nanoflakes [Volume 11, Issue 4, 2023, Pages 877-887]
Adsorption Elaboration and Characterization of Organo-Ghassoul (Moroccan Clay) as an Adsorbent Using Cationic Surfactant for Anionic Dye Adsorption [Volume 11, Issue 4, 2023, Pages 913-928]
Alkanes Heat-Refluxextraction (HRE) and GC/MS Analysis of Polycyclic Aromatic Hydrocarbons and Their Nitrted Derivatives Adsorbed on Diesel Combustion Engine Prticles [Volume 11, Issue 2, 2023, Pages 203-219]
Allura Red Optimization of Adsorption Process Parameters of Allura Red Removal Using Nanodiopside/Zn-Fe Layered Double Hydroxide Composite by Response Surface Methodology: A Kinetic, Thermodynamic, and Equilibrium Approach [Volume 11, Issue 1, 2023, Pages 63-78]
Amberlite IRA-68 Adsorption of Vanadium Using Amberlite IRA-68 Resin from Aqueous Solution: Kinetics and Thermodynamics Studies [Volume 11, Issue 4, 2023, Pages 929-942]
Ambient pressure drying Structural, Morphological and Physiochemical Analysis of SiC8H20O4/C2H5O/C7H16 Modified Mesoporous Silica Aerogels [Volume 11, Issue 1, 2023, Pages 1-8]
Ambroxol hydrochloride Comparative Kinetic Study of Palladium(II) Catalyzed and Uncatalyzed Oxidation of Ambroxol Hydrochloride with Potassium Permanganate in an Aqueous Alkaline Medium: A Mechanistic Approach [Volume 11, Issue 4, 2023, Pages 865-875]
Anisotropy Influence of Nanoscopic Micellar Confinements and Rotational Dynamics of Anticancer Drug Doxorubicin [Volume 11, Issue 3, 2023, Pages 471-479]
Antiandrogens In-Silico Molecular Docking, Validation, Drug-Likeness, and ADMET Studies of Antiandrogens to Use in the Fight against SARS-CoV-2 [Volume 11, Issue 1, 2023, Pages 9-21]
Antibody-Antigen docking Monoclonal Antibodies as Potential Treatment Drugs for Nsp15 and 3CLpro Proteins [Volume 11, Issue 3, 2023, Pages 623-629]
Antimicrobial Synthesis, Antifungal Activity, and Molecular Docking Studies of Some New Di-O-Isopentanoyl Glucopyranosides [Volume 11, Issue 1, 2023, Pages 149-157]
Antiviral compounds Molecular Analysis of Potential Inhibitors Against SARS-CoV-2: Computational Approach [Volume 11, Issue 4, 2023, Pages 725-734]
Aqueous solution Solamen Vaillanti Mollusk Powder as an Efficient Biosorbent for Removing Cobalt Ions from Aqueous Solution: Kinetic and Equilibrium Studies [Volume 11, Issue 1, 2023, Pages 159-169]
Arthrobacter globiformis An Approach to Increase the Efficiency of Uricase by Computational Mutagenesis [Volume 11, Issue 3, 2023, Pages 481-491]
Artificial Neural Network Deactivation of Iron Fischer-Tropsch Catalyst in the Presence of Different Promoters: Model Determination and Parameter Estimation Using a Hybrid ANN/GPLE Technique [Volume 11, Issue 4, 2023, Pages 761-770]
Ascorbic acid Quantum Calculations of some Electronic and Structural Parameters for the System of Vitamin C and Different Sulfoxide Solvents [Volume 11, Issue 3, 2023, Pages 643-651]
As(V) Bio-sorption of As(V) from Aqueous Solutions by Thuja Occidentalis Leaves Activated Carbon@Al Embedded Material [Volume 11, Issue 2, 2023, Pages 287-297]
AT DFT Study on the Carcinogenicity of some Common Polycyclic Aromatic Hydrocarbons (PAH) [Volume 11, Issue 3, 2023, Pages 537-548]
Average roughness Physical Study of PVA Filled with Carbon Nanotube and Nano Carbon with Roughness Morphology [Volume 11, Issue 4, 2023, Pages 747-760]
Azo dye Adsorption of an Azo Dye on Graphene Nanosheet: A Molecular Dynamics Simulation Study [Volume 11, Issue 1, 2023, Pages 117-127]

B

B3LYP Quantum Calculations of some Electronic and Structural Parameters for the System of Vitamin C and Different Sulfoxide Solvents [Volume 11, Issue 3, 2023, Pages 643-651]
Bacillus fastidious An Approach to Increase the Efficiency of Uricase by Computational Mutagenesis [Volume 11, Issue 3, 2023, Pages 481-491]
Bentonite Flocculation of Clay Suspensions Using Copolymers Based on Acrylamide and Biopolymer [Volume 11, Issue 2, 2023, Pages 221-230]
Biodegradable Nano-based Biodegradable Food Packaging of Vitis-Vinifera Synthesized by PVA/ZnO Nanocomposites [Volume 11, Issue 2, 2023, Pages 449-458]
Biofilm Identification of a Potential Thiazole Inhibitor Against Biofilms by 3D QSAR, Molecular Docking, DFT Analysis, MM-PBSA Binding Energy Calculations, and Molecular Dynamics Simulation [Volume 11, Issue 2, 2023, Pages 369-389]
Bioinformatics tools In Silico Analysis Predicting the Structural and Functional Effects of High-risk nsSNPs in the Human GCK Gene Associated with Gestational Diabetes [Volume 11, Issue 3, 2023, Pages 653-673]
Biological compound Quantum Calculations of some Electronic and Structural Parameters for the System of Vitamin C and Different Sulfoxide Solvents [Volume 11, Issue 3, 2023, Pages 643-651]
Biosensor In Silico Study of the Effect of Porphyrin-Based Ligands on the Structure of G-Quadruplex in the Presence of Different Ions [Volume 11, Issue 4, 2023, Pages 695-705]
Biosorption Solamen Vaillanti Mollusk Powder as an Efficient Biosorbent for Removing Cobalt Ions from Aqueous Solution: Kinetic and Equilibrium Studies [Volume 11, Issue 1, 2023, Pages 159-169]
Boron nitride nanotubes (BNNTs) New Insights in the Use of Boron Nitrogen Nanotubes as Cisplatin Nanovector [Volume 11, Issue 2, 2023, Pages 253-265]
Brilliant orange (BO) dye Enhanced Removal of Brilliant Orange by Poly(4-vinylpyridine)/Acid-Activated Bentonite Composite [Volume 11, Issue 2, 2023, Pages 327-339]

C

CADD Structural Insight into 2-Aryl-4-Quinoline Carboxylic Acid-Based Dihydroorotate Dehydrogenase (DHODH) and its Potential Anti-SARS-CoV-2 Activity Through Pharmacophore Modeling, Multidimensional QSAR, ADME, and Docking Studies [Volume 11, Issue 4, 2023, Pages 783-800]
Cadmium Structural, Optical, and Luminescence Studies of Sm2O3-Doped Cd2Sr(PO4)2 Nanopowder [Volume 11, Issue 3, 2023, Pages 501-510]
Cameroon flora In Silico Approach for Designing Novel SARS-CoV-2 Inhibitors from Medicinal Plants [Volume 11, Issue 3, 2023, Pages 589-604]
Caproic Acid Measurement and Thermodynamic Modeling of LLE Data of Ternary System (Water + Caproic Acid + Undecan-1-ol) at 298.2 K [Volume 11, Issue 3, 2023, Pages 615-622]
Carbon dioxide Adsorption of Some Gas Molecules on the Surface of Graphene Nanoflakes [Volume 11, Issue 4, 2023, Pages 877-887]
Carbon disulfide Adsorption of Some Gas Molecules on the Surface of Graphene Nanoflakes [Volume 11, Issue 4, 2023, Pages 877-887]
Carbon monoxide Interaction of Electronically Excited CO(a^3 Π_r) Molecules with H, H2, and H2O: Potential Energy Surfaces and Reaction Kinetics [Volume 11, Issue 4, 2023, Pages 837-851]
Carboxymethylcellulose sodium salt Ion Pair [NaCMC-CAPB] Complex Formed via Interaction of Carboxymethylcellulose Sodium Salt (NaCMC) with Cocamidopropyl Betaine (CAPB) [Volume 11, Issue 3, 2023, Pages 549-558]
Catalytic and photocatalytic activities The Effect of Sr-Doping on Structural, Optical, Catalytic, and Photocatalytic Properties of α-MnO2 Nanowires Synthesized via a Hydrothermal Route [Volume 11, Issue 3, 2023, Pages 559-574]
Catalytic oxidative desulfurization method Synthesis MnMoP/γ-Al2O3 Oxidative Desulfurization Catalyst and Optimized the Operating Conditions of the Catalytic ODS Method of Condensate [Volume 11, Issue 1, 2023, Pages 49-61]
Catalytic oxidative desulfurization process The Preparation of FeMo/γ-Al2O3 Extruded Catalyst and Optimization of the Operating Conditions of the ODS of Light Oil Naphtha [Volume 11, Issue 2, 2023, Pages 191-202]
CDK2 Novel Styrylquinoline Derivatives as Potential Anticancer Agents, In-Silico studies by 3D-QSAR, Molecular Docking, and Molecular Dynamics Simulations [Volume 11, Issue 4, 2023, Pages 953-967]
CdO-FePO4 CNPs Comparative Study of Crystallite Size from XRD and TEM Results for Pure and V2O5 Doped CdO-FePO4 Composite Nanopowders [Volume 11, Issue 2, 2023, Pages 241-251]
Ceramic materials An Investigation of the Electrophysical Properties of Composite Ceramic Materials Containing Nickel Nanoparticles [Volume 11, Issue 2, 2023, Pages 231-239]
Chemical approach Photocatalytic Degradation of Rhodamine B and Methylene blue Using α-Fe2O3 Nanoparticles [Volume 11, Issue 1, 2023, Pages 139-147]
Chemical descriptor Reactivity of Isothiasole with Dibromine and Sulfuryl Chloride [Volume 11, Issue 3, 2023, Pages 511-525]
Chemiluminescence Interaction of Electronically Excited CO(a^3 Π_r) Molecules with H, H2, and H2O: Potential Energy Surfaces and Reaction Kinetics [Volume 11, Issue 4, 2023, Pages 837-851]
Choline chloride Insights into the Lignin Dissolution Mechanism of Water Content Tailored-choline Chloride (ChCl) Based Green Solvents for Biomass Pretreatment [Volume 11, Issue 3, 2023, Pages 605-614]
Cisplatin New Insights in the Use of Boron Nitrogen Nanotubes as Cisplatin Nanovector [Volume 11, Issue 2, 2023, Pages 253-265]
CMC Flocculation of Clay Suspensions Using Copolymers Based on Acrylamide and Biopolymer [Volume 11, Issue 2, 2023, Pages 221-230]
Cobalt heavy metal Solamen Vaillanti Mollusk Powder as an Efficient Biosorbent for Removing Cobalt Ions from Aqueous Solution: Kinetic and Equilibrium Studies [Volume 11, Issue 1, 2023, Pages 159-169]
Cocamidopropyl betaine Ion Pair [NaCMC-CAPB] Complex Formed via Interaction of Carboxymethylcellulose Sodium Salt (NaCMC) with Cocamidopropyl Betaine (CAPB) [Volume 11, Issue 3, 2023, Pages 549-558]
Color purity Structural, Optical, and Luminescence Studies of Sm2O3-Doped Cd2Sr(PO4)2 Nanopowder [Volume 11, Issue 3, 2023, Pages 501-510]
Combustion diagnostics Interaction of Electronically Excited CO(a^3 Π_r) Molecules with H, H2, and H2O: Potential Energy Surfaces and Reaction Kinetics [Volume 11, Issue 4, 2023, Pages 837-851]
Complex Ion Pair [NaCMC-CAPB] Complex Formed via Interaction of Carboxymethylcellulose Sodium Salt (NaCMC) with Cocamidopropyl Betaine (CAPB) [Volume 11, Issue 3, 2023, Pages 549-558]
Conformation Neutralization Degree Effect on Potentiometric Behavior of Poly(N-octyl-4-vinylpyridinium Bromide) [Volume 11, Issue 1, 2023, Pages 91-101]
Copper(I) oxide Pulsed Plasma-Chemical Synthesis of CuxOy-TiO2 Nanocomposite [Volume 11, Issue 2, 2023, Pages 425-436]
Co-precipitation Removal of Pb(II) Ion from Aqueous Solution Using As-synthesized CuO/Cu2O Nanocomposites [Volume 11, Issue 1, 2023, Pages 171-180]
Corrosion inhibitor Curcumin and Curcumin Derivatives as Green Corrosion Inhabitor-A Review [Volume 11, Issue 4, 2023, Pages 825-835]
Cosolvency models Solubility of Lamotrigine in Polyethylene Glycol 400 + 2-Propanol Mixtures at Different Temperatures [Volume 11, Issue 3, 2023, Pages 675-682]
COVID-19 Monoclonal Antibodies as Potential Treatment Drugs for Nsp15 and 3CLpro Proteins [Volume 11, Issue 3, 2023, Pages 623-629]
COVID-19 Towards Screening and Repurposing of Approved Drugs for the Treatment of COVID-19 Using Molecular Docking [Volume 11, Issue 4, 2023, Pages 707-723]
COVID-19 Molecular Analysis of Potential Inhibitors Against SARS-CoV-2: Computational Approach [Volume 11, Issue 4, 2023, Pages 725-734]
Critical neutralization degree Neutralization Degree Effect on Potentiometric Behavior of Poly(N-octyl-4-vinylpyridinium Bromide) [Volume 11, Issue 1, 2023, Pages 91-101]
CuO/Cu2O nanocomposites Removal of Pb(II) Ion from Aqueous Solution Using As-synthesized CuO/Cu2O Nanocomposites [Volume 11, Issue 1, 2023, Pages 171-180]
Curcumin and Curcumin derivatives Curcumin and Curcumin Derivatives as Green Corrosion Inhabitor-A Review [Volume 11, Issue 4, 2023, Pages 825-835]

D

Deactivation models Deactivation of Iron Fischer-Tropsch Catalyst in the Presence of Different Promoters: Model Determination and Parameter Estimation Using a Hybrid ANN/GPLE Technique [Volume 11, Issue 4, 2023, Pages 761-770]
DEC Study of Molecular Interactions of Fossil Fuels through Acoustic and Volumetric Data [Volume 11, Issue 1, 2023, Pages 129-137]
Degree of sulfonation Methods of Recycling Expanded Polystyrene Waste: Synthesis and Characterization [Volume 11, Issue 4, 2023, Pages 943-951]
Density Volumetric Properties of Nanofluids by a Perturbed Hard-sphere Chain Equation of State [Volume 11, Issue 4, 2023, Pages 735-745]
Density Thermophysical Study of Ethylene Glycol + H2O and Ethylene Glycol + (DMF/H2O) at 298.15 K [Volume 11, Issue 4, 2023, Pages 889-896]
DFT New Insights in the Use of Boron Nitrogen Nanotubes as Cisplatin Nanovector [Volume 11, Issue 2, 2023, Pages 253-265]
DFT Insights into the Electronic Properties of Coumarins: A Comparative Study Synthesis, Characterization, and Theoretical Study of New Peptides Obtained by Opening Reactions of Sulfahydantoins [Volume 11, Issue 2, 2023, Pages 341-352]
DFT Identification of a Potential Thiazole Inhibitor Against Biofilms by 3D QSAR, Molecular Docking, DFT Analysis, MM-PBSA Binding Energy Calculations, and Molecular Dynamics Simulation [Volume 11, Issue 2, 2023, Pages 369-389]
DFT A Comparative Study Through DFT Investigation and Molecular Docking Studies of Potential Dietary Phytochemicals Against Cancer Target-DNA Topoisomerase III [Volume 11, Issue 2, 2023, Pages 391-408]
DFT Reactivity of Isothiasole with Dibromine and Sulfuryl Chloride [Volume 11, Issue 3, 2023, Pages 511-525]
DFT DFT Study on the Carcinogenicity of some Common Polycyclic Aromatic Hydrocarbons (PAH) [Volume 11, Issue 3, 2023, Pages 537-548]
DFT Quantum Calculations of some Electronic and Structural Parameters for the System of Vitamin C and Different Sulfoxide Solvents [Volume 11, Issue 3, 2023, Pages 643-651]
DFT calculation COMPUTATIONAL INVESTIGATION OF GENIPOSIDIC ACID AS AN ANTICANCER AGENT USING MOLECULAR DOCKING, MOLECULAR DYNAMIC SIMULATION, DFT CALCULATION, AND OSIRIS-MOLINSPIRATION PROFILING [Volume 11, Issue 4, 2023, Pages 801-823]
DFT calculations A DFT Study of Hydrogen Adsorption on Metallic Platinum: Associative or Dissociative Adsorption [Volume 11, Issue 3, 2023, Pages 527-536]
Dibromine Reactivity of Isothiasole with Dibromine and Sulfuryl Chloride [Volume 11, Issue 3, 2023, Pages 511-525]
Diesel exhaust particles Heat-Refluxextraction (HRE) and GC/MS Analysis of Polycyclic Aromatic Hydrocarbons and Their Nitrted Derivatives Adsorbed on Diesel Combustion Engine Prticles [Volume 11, Issue 2, 2023, Pages 203-219]
Dietary phytochemicals A Comparative Study Through DFT Investigation and Molecular Docking Studies of Potential Dietary Phytochemicals Against Cancer Target-DNA Topoisomerase III [Volume 11, Issue 2, 2023, Pages 391-408]
Diffuse reflectance spectroscopy Structural, Optical, and Luminescence Studies of Sm2O3-Doped Cd2Sr(PO4)2 Nanopowder [Volume 11, Issue 3, 2023, Pages 501-510]
Dihydroorotate dehydrogenase Structural Insight into 2-Aryl-4-Quinoline Carboxylic Acid-Based Dihydroorotate Dehydrogenase (DHODH) and its Potential Anti-SARS-CoV-2 Activity Through Pharmacophore Modeling, Multidimensional QSAR, ADME, and Docking Studies [Volume 11, Issue 4, 2023, Pages 783-800]
Dimethyl Formamide Thermophysical Study of Ethylene Glycol + H2O and Ethylene Glycol + (DMF/H2O) at 298.15 K [Volume 11, Issue 4, 2023, Pages 889-896]
Dissolution thermodynamics Solubility of Lamotrigine in Polyethylene Glycol 400 + 2-Propanol Mixtures at Different Temperatures [Volume 11, Issue 3, 2023, Pages 675-682]
DNA topoisomerase III beta A Comparative Study Through DFT Investigation and Molecular Docking Studies of Potential Dietary Phytochemicals Against Cancer Target-DNA Topoisomerase III [Volume 11, Issue 2, 2023, Pages 391-408]
Docking An Approach to Increase the Efficiency of Uricase by Computational Mutagenesis [Volume 11, Issue 3, 2023, Pages 481-491]
Docking molecular Identification of a Potential Thiazole Inhibitor Against Biofilms by 3D QSAR, Molecular Docking, DFT Analysis, MM-PBSA Binding Energy Calculations, and Molecular Dynamics Simulation [Volume 11, Issue 2, 2023, Pages 369-389]
Donor materials First-Principles Study on Optoelectronic and Photovoltaic Properties in a P3HT/PCBM Complex [Volume 11, Issue 2, 2023, Pages 299-313]
Dye RSM Optimized Adsorption of Eriochrome Black T Dye onto Alumina Nanoprticles: Isotherm and Kinetics Studies [Volume 11, Issue 2, 2023, Pages 315-326]
Dynamic viscosity A Numerical Investigation of the Thermal Transport Properties of Argon + Hydrogen Plasma Working Gases in the Presence of Various TiO2 Precursor Solutions [Volume 11, Issue 4, 2023, Pages 897-912]

E

Electrophysical properties An Investigation of the Electrophysical Properties of Composite Ceramic Materials Containing Nickel Nanoparticles [Volume 11, Issue 2, 2023, Pages 231-239]
Elementary processes Interaction of Electronically Excited CO(a^3 Π_r) Molecules with H, H2, and H2O: Potential Energy Surfaces and Reaction Kinetics [Volume 11, Issue 4, 2023, Pages 837-851]
Emissions Spectra Enhanced Luminescence and Energy Transfer of Bi3+/Dy3+ Co-doped La2Zr2O7 Nanophosphors for pc-LED Applications [Volume 11, Issue 1, 2023, Pages 23-31]
Energy-transfer Enhanced Luminescence and Energy Transfer of Bi3+/Dy3+ Co-doped La2Zr2O7 Nanophosphors for pc-LED Applications [Volume 11, Issue 1, 2023, Pages 23-31]
Equation of state Volumetric Properties of Nanofluids by a Perturbed Hard-sphere Chain Equation of State [Volume 11, Issue 4, 2023, Pages 735-745]
Ethylene glycol Thermophysical Study of Ethylene Glycol + H2O and Ethylene Glycol + (DMF/H2O) at 298.15 K [Volume 11, Issue 4, 2023, Pages 889-896]
Excess functions Study of Molecular Interactions of Fossil Fuels through Acoustic and Volumetric Data [Volume 11, Issue 1, 2023, Pages 129-137]
Excess Gibbs Energy Study of Phase Equilibria for the n-Butane + Methanol System from 323.22 K to 423.09 K [Volume 11, Issue 1, 2023, Pages 103-116]
Excitation Enhanced Luminescence and Energy Transfer of Bi3+/Dy3+ Co-doped La2Zr2O7 Nanophosphors for pc-LED Applications [Volume 11, Issue 1, 2023, Pages 23-31]

F

FCC surfaces A DFT Study of Hydrogen Adsorption on Metallic Platinum: Associative or Dissociative Adsorption [Volume 11, Issue 3, 2023, Pages 527-536]
FeMo/γ-Al2O3 Extruded catalyst The Preparation of FeMo/γ-Al2O3 Extruded Catalyst and Optimization of the Operating Conditions of the ODS of Light Oil Naphtha [Volume 11, Issue 2, 2023, Pages 191-202]
FE-SEM Synthesis of TiO2 Nanoparticles by Hydrothermal Method and Characterization of their Antibacterial Activity: Investigation of the Impact of Magnetism on the Photocatalytic Properties of the Nanoparticles [Volume 11, Issue 4, 2023, Pages 771-782]
Flocculant Flocculation of Clay Suspensions Using Copolymers Based on Acrylamide and Biopolymer [Volume 11, Issue 2, 2023, Pages 221-230]
FMO First-Principles Study on Optoelectronic and Photovoltaic Properties in a P3HT/PCBM Complex [Volume 11, Issue 2, 2023, Pages 299-313]
Food packaging Nano-based Biodegradable Food Packaging of Vitis-Vinifera Synthesized by PVA/ZnO Nanocomposites [Volume 11, Issue 2, 2023, Pages 449-458]
Formaldehyde Removal of Formaldehyde from Aqueous Solution Using Low-cost and Reusable Adsorbents [Volume 11, Issue 4, 2023, Pages 853-864]
Fruit quality Nano-based Biodegradable Food Packaging of Vitis-Vinifera Synthesized by PVA/ZnO Nanocomposites [Volume 11, Issue 2, 2023, Pages 449-458]
FTIR Bio-sorption of As(V) from Aqueous Solutions by Thuja Occidentalis Leaves Activated Carbon@Al Embedded Material [Volume 11, Issue 2, 2023, Pages 287-297]
FTIR spectroscopy Methods of Recycling Expanded Polystyrene Waste: Synthesis and Characterization [Volume 11, Issue 4, 2023, Pages 943-951]

G

GC DFT Study on the Carcinogenicity of some Common Polycyclic Aromatic Hydrocarbons (PAH) [Volume 11, Issue 3, 2023, Pages 537-548]
GCK In Silico Analysis Predicting the Structural and Functional Effects of High-risk nsSNPs in the Human GCK Gene Associated with Gestational Diabetes [Volume 11, Issue 3, 2023, Pages 653-673]
Genetic susceptibility In Silico Analysis Predicting the Structural and Functional Effects of High-risk nsSNPs in the Human GCK Gene Associated with Gestational Diabetes [Volume 11, Issue 3, 2023, Pages 653-673]
Geniposidic acid COMPUTATIONAL INVESTIGATION OF GENIPOSIDIC ACID AS AN ANTICANCER AGENT USING MOLECULAR DOCKING, MOLECULAR DYNAMIC SIMULATION, DFT CALCULATION, AND OSIRIS-MOLINSPIRATION PROFILING [Volume 11, Issue 4, 2023, Pages 801-823]
Gestational diabetes In Silico Analysis Predicting the Structural and Functional Effects of High-risk nsSNPs in the Human GCK Gene Associated with Gestational Diabetes [Volume 11, Issue 3, 2023, Pages 653-673]
Glucose esters Synthesis, Antifungal Activity, and Molecular Docking Studies of Some New Di-O-Isopentanoyl Glucopyranosides [Volume 11, Issue 1, 2023, Pages 149-157]
GPLE Deactivation of Iron Fischer-Tropsch Catalyst in the Presence of Different Promoters: Model Determination and Parameter Estimation Using a Hybrid ANN/GPLE Technique [Volume 11, Issue 4, 2023, Pages 761-770]
G-quadruplex In Silico Study of the Effect of Porphyrin-Based Ligands on the Structure of G-Quadruplex in the Presence of Different Ions [Volume 11, Issue 4, 2023, Pages 695-705]
Granular Ferric Hydroxide (GFH) Performance of a Recirculating Fixed Bed Reactor for the Oxidation of Phenol and Trisubstituted Phenols by Heterogeneous Photocatalytic Process-mechanistic, Kinetic and Substituents Approach [Volume 11, Issue 1, 2023, Pages 79-89]
Green Nanotechnology Nano-based Biodegradable Food Packaging of Vitis-Vinifera Synthesized by PVA/ZnO Nanocomposites [Volume 11, Issue 2, 2023, Pages 449-458]
Green solvents Insights into the Lignin Dissolution Mechanism of Water Content Tailored-choline Chloride (ChCl) Based Green Solvents for Biomass Pretreatment [Volume 11, Issue 3, 2023, Pages 605-614]

H

Hammett constants Performance of a Recirculating Fixed Bed Reactor for the Oxidation of Phenol and Trisubstituted Phenols by Heterogeneous Photocatalytic Process-mechanistic, Kinetic and Substituents Approach [Volume 11, Issue 1, 2023, Pages 79-89]
Hematite nanoparticles Photocatalytic Degradation of Rhodamine B and Methylene blue Using α-Fe2O3 Nanoparticles [Volume 11, Issue 1, 2023, Pages 139-147]
HMBC Synthesis, Antifungal Activity, and Molecular Docking Studies of Some New Di-O-Isopentanoyl Glucopyranosides [Volume 11, Issue 1, 2023, Pages 149-157]
Hydrogen bond Molecular Structure, Linear, and Nonlinear Optical Properties of Piperazine-1,4-Diium Bis 2,4,6-Trinitrophenolate: A Theoretical Investigation [Volume 11, Issue 1, 2023, Pages 33-48]
Hydrogen bond Quantum Calculations of some Electronic and Structural Parameters for the System of Vitamin C and Different Sulfoxide Solvents [Volume 11, Issue 3, 2023, Pages 643-651]
Hydrogen bonding Insights into the Lignin Dissolution Mechanism of Water Content Tailored-choline Chloride (ChCl) Based Green Solvents for Biomass Pretreatment [Volume 11, Issue 3, 2023, Pages 605-614]
Hydrothermal method Synthesis of TiO2 Nanoparticles by Hydrothermal Method and Characterization of their Antibacterial Activity: Investigation of the Impact of Magnetism on the Photocatalytic Properties of the Nanoparticles [Volume 11, Issue 4, 2023, Pages 771-782]
Hydrothermal Synthesis The Effect of Sr-Doping on Structural, Optical, Catalytic, and Photocatalytic Properties of α-MnO2 Nanowires Synthesized via a Hydrothermal Route [Volume 11, Issue 3, 2023, Pages 559-574]
Hyperpolarizability Molecular Structure, Linear, and Nonlinear Optical Properties of Piperazine-1,4-Diium Bis 2,4,6-Trinitrophenolate: A Theoretical Investigation [Volume 11, Issue 1, 2023, Pages 33-48]

I

ICT Insights into the Electronic Properties of Coumarins: A Comparative Study [Volume 11, Issue 2, 2023, Pages 267-286]
Inclination Angle Combined Effects of Inclination Angle and Imposed Flow on Mixed Convective Cooling Inside a Vented Cavity Crossed by Nanofluids [Volume 11, Issue 3, 2023, Pages 631-642]
Indole triazole Prediction of Novel TRPV1 Antagonist: A Combination of 3D-QSAR, Molecular Docking, MD Simulations and ADMET Prediction [Volume 11, Issue 2, 2023, Pages 353-368]
Inhibitor efficiency Curcumin and Curcumin Derivatives as Green Corrosion Inhabitor-A Review [Volume 11, Issue 4, 2023, Pages 825-835]
In silico mutagenesis An Approach to Increase the Efficiency of Uricase by Computational Mutagenesis [Volume 11, Issue 3, 2023, Pages 481-491]
In silico mutagenesis A Computational Investigation on Immunogenicity of Uricase from Aspergillus Flavus and Candida Utilis [Volume 11, Issue 3, 2023, Pages 683-693]
Interaction Ion Pair [NaCMC-CAPB] Complex Formed via Interaction of Carboxymethylcellulose Sodium Salt (NaCMC) with Cocamidopropyl Betaine (CAPB) [Volume 11, Issue 3, 2023, Pages 549-558]
Iron catalyst Deactivation of Iron Fischer-Tropsch Catalyst in the Presence of Different Promoters: Model Determination and Parameter Estimation Using a Hybrid ANN/GPLE Technique [Volume 11, Issue 4, 2023, Pages 761-770]
Isentropic compressibility Study of Molecular Interactions of Fossil Fuels through Acoustic and Volumetric Data [Volume 11, Issue 1, 2023, Pages 129-137]
Isotherm Adsorption of Vanadium Using Amberlite IRA-68 Resin from Aqueous Solution: Kinetics and Thermodynamics Studies [Volume 11, Issue 4, 2023, Pages 929-942]

K

Kaolin Flocculation of Clay Suspensions Using Copolymers Based on Acrylamide and Biopolymer [Volume 11, Issue 2, 2023, Pages 221-230]
Kinetics Comparative Kinetic Study of Palladium(II) Catalyzed and Uncatalyzed Oxidation of Ambroxol Hydrochloride with Potassium Permanganate in an Aqueous Alkaline Medium: A Mechanistic Approach [Volume 11, Issue 4, 2023, Pages 865-875]
Kinetics Adsorption of Vanadium Using Amberlite IRA-68 Resin from Aqueous Solution: Kinetics and Thermodynamics Studies [Volume 11, Issue 4, 2023, Pages 929-942]
Kinetic study Elaboration and Characterization of Organo-Ghassoul (Moroccan Clay) as an Adsorbent Using Cationic Surfactant for Anionic Dye Adsorption [Volume 11, Issue 4, 2023, Pages 913-928]

L

Langmuir Removal of Pb(II) Ion from Aqueous Solution Using As-synthesized CuO/Cu2O Nanocomposites [Volume 11, Issue 1, 2023, Pages 171-180]
Lanosterol 14-α-demethylase Synthesis, Antifungal Activity, and Molecular Docking Studies of Some New Di-O-Isopentanoyl Glucopyranosides [Volume 11, Issue 1, 2023, Pages 149-157]
Layered double hydroxide Optimization of Adsorption Process Parameters of Allura Red Removal Using Nanodiopside/Zn-Fe Layered Double Hydroxide Composite by Response Surface Methodology: A Kinetic, Thermodynamic, and Equilibrium Approach [Volume 11, Issue 1, 2023, Pages 63-78]
Lifetime Influence of Nanoscopic Micellar Confinements and Rotational Dynamics of Anticancer Drug Doxorubicin [Volume 11, Issue 3, 2023, Pages 471-479]
Lignin dissolution Insights into the Lignin Dissolution Mechanism of Water Content Tailored-choline Chloride (ChCl) Based Green Solvents for Biomass Pretreatment [Volume 11, Issue 3, 2023, Pages 605-614]
Liquid-liquid equilibrium Measurement and Thermodynamic Modeling of LLE Data of Ternary System (Water + Caproic Acid + Undecan-1-ol) at 298.2 K [Volume 11, Issue 3, 2023, Pages 615-622]

M

MD simulation COMPUTATIONAL INVESTIGATION OF GENIPOSIDIC ACID AS AN ANTICANCER AGENT USING MOLECULAR DOCKING, MOLECULAR DYNAMIC SIMULATION, DFT CALCULATION, AND OSIRIS-MOLINSPIRATION PROFILING [Volume 11, Issue 4, 2023, Pages 801-823]
MD Simulations Identification of a Potential Thiazole Inhibitor Against Biofilms by 3D QSAR, Molecular Docking, DFT Analysis, MM-PBSA Binding Energy Calculations, and Molecular Dynamics Simulation [Volume 11, Issue 2, 2023, Pages 369-389]
MD Simulations Novel Styrylquinoline Derivatives as Potential Anticancer Agents, In-Silico studies by 3D-QSAR, Molecular Docking, and Molecular Dynamics Simulations [Volume 11, Issue 4, 2023, Pages 953-967]
MEP First-Principles Study on Optoelectronic and Photovoltaic Properties in a P3HT/PCBM Complex [Volume 11, Issue 2, 2023, Pages 299-313]
MEP A Comparative Study Through DFT Investigation and Molecular Docking Studies of Potential Dietary Phytochemicals Against Cancer Target-DNA Topoisomerase III [Volume 11, Issue 2, 2023, Pages 391-408]
Mesoporous Structural, Morphological and Physiochemical Analysis of SiC8H20O4/C2H5O/C7H16 Modified Mesoporous Silica Aerogels [Volume 11, Issue 1, 2023, Pages 1-8]
Mesoporous alumina RSM Optimized Adsorption of Eriochrome Black T Dye onto Alumina Nanoprticles: Isotherm and Kinetics Studies [Volume 11, Issue 2, 2023, Pages 315-326]
Metal ion In Silico Study of the Effect of Porphyrin-Based Ligands on the Structure of G-Quadruplex in the Presence of Different Ions [Volume 11, Issue 4, 2023, Pages 695-705]
Methanol Study of Phase Equilibria for the n-Butane + Methanol System from 323.22 K to 423.09 K [Volume 11, Issue 1, 2023, Pages 103-116]
Methylene blue Insights into the Electronic Properties of Coumarins: A Comparative Study Synthesis and Characterization of Fe2O3/Mn2O3 Magnetic Nanocomposites for the Photocatalytic Degradation of Methylene Blue [Volume 11, Issue 2, 2023, Pages 437-447]
Methylene blue The Effect of Sr-Doping on Structural, Optical, Catalytic, and Photocatalytic Properties of α-MnO2 Nanowires Synthesized via a Hydrothermal Route [Volume 11, Issue 3, 2023, Pages 559-574]
Methyl phenol Study of Molecular Interactions of Fossil Fuels through Acoustic and Volumetric Data [Volume 11, Issue 1, 2023, Pages 129-137]
Micelle Influence of Nanoscopic Micellar Confinements and Rotational Dynamics of Anticancer Drug Doxorubicin [Volume 11, Issue 3, 2023, Pages 471-479]
Missense variants In Silico Analysis Predicting the Structural and Functional Effects of High-risk nsSNPs in the Human GCK Gene Associated with Gestational Diabetes [Volume 11, Issue 3, 2023, Pages 653-673]
Mixed convection Combined Effects of Inclination Angle and Imposed Flow on Mixed Convective Cooling Inside a Vented Cavity Crossed by Nanofluids [Volume 11, Issue 3, 2023, Pages 631-642]
MMGBA Molecular Analysis of Potential Inhibitors Against SARS-CoV-2: Computational Approach [Volume 11, Issue 4, 2023, Pages 725-734]
MnMoP/γ-Al2O3 catalyst Synthesis MnMoP/γ-Al2O3 Oxidative Desulfurization Catalyst and Optimized the Operating Conditions of the Catalytic ODS Method of Condensate [Volume 11, Issue 1, 2023, Pages 49-61]
Modeling Volumetric Properties of Nanofluids by a Perturbed Hard-sphere Chain Equation of State [Volume 11, Issue 4, 2023, Pages 735-745]
Molecular adsorption A DFT Study of Hydrogen Adsorption on Metallic Platinum: Associative or Dissociative Adsorption [Volume 11, Issue 3, 2023, Pages 527-536]
Molecular docking In-Silico Molecular Docking, Validation, Drug-Likeness, and ADMET Studies of Antiandrogens to Use in the Fight against SARS-CoV-2 [Volume 11, Issue 1, 2023, Pages 9-21]
Molecular docking Prediction of Novel TRPV1 Antagonist: A Combination of 3D-QSAR, Molecular Docking, MD Simulations and ADMET Prediction [Volume 11, Issue 2, 2023, Pages 353-368]
Molecular docking A Comparative Study Through DFT Investigation and Molecular Docking Studies of Potential Dietary Phytochemicals Against Cancer Target-DNA Topoisomerase III [Volume 11, Issue 2, 2023, Pages 391-408]
Molecular docking Discovery of New Inhibitors of Enoyl-ACP Reductase via Structure-Based Virtual Screening [Volume 11, Issue 3, 2023, Pages 459-469]
Molecular docking In Silico Approach for Designing Novel SARS-CoV-2 Inhibitors from Medicinal Plants [Volume 11, Issue 3, 2023, Pages 589-604]
Molecular docking Towards Screening and Repurposing of Approved Drugs for the Treatment of COVID-19 Using Molecular Docking [Volume 11, Issue 4, 2023, Pages 707-723]
Molecular docking COMPUTATIONAL INVESTIGATION OF GENIPOSIDIC ACID AS AN ANTICANCER AGENT USING MOLECULAR DOCKING, MOLECULAR DYNAMIC SIMULATION, DFT CALCULATION, AND OSIRIS-MOLINSPIRATION PROFILING [Volume 11, Issue 4, 2023, Pages 801-823]
Molecular docking Novel Styrylquinoline Derivatives as Potential Anticancer Agents, In-Silico studies by 3D-QSAR, Molecular Docking, and Molecular Dynamics Simulations [Volume 11, Issue 4, 2023, Pages 953-967]
Molecular Dynamics In Silico Approach for Designing Novel SARS-CoV-2 Inhibitors from Medicinal Plants [Volume 11, Issue 3, 2023, Pages 589-604]
Molecular Dynamic Simulation Prediction of Novel TRPV1 Antagonist: A Combination of 3D-QSAR, Molecular Docking, MD Simulations and ADMET Prediction [Volume 11, Issue 2, 2023, Pages 353-368]
Molecular Dynamics Simulation Adsorption of an Azo Dye on Graphene Nanosheet: A Molecular Dynamics Simulation Study [Volume 11, Issue 1, 2023, Pages 117-127]
Molecular Modeling Structural Insight into 2-Aryl-4-Quinoline Carboxylic Acid-Based Dihydroorotate Dehydrogenase (DHODH) and its Potential Anti-SARS-CoV-2 Activity Through Pharmacophore Modeling, Multidimensional QSAR, ADME, and Docking Studies [Volume 11, Issue 4, 2023, Pages 783-800]
Molecular orbitals Insights into the Electronic Properties of Coumarins: A Comparative Study [Volume 11, Issue 2, 2023, Pages 267-286]
Molecular structure Molecular Structure, Linear, and Nonlinear Optical Properties of Piperazine-1,4-Diium Bis 2,4,6-Trinitrophenolate: A Theoretical Investigation [Volume 11, Issue 1, 2023, Pages 33-48]
Mollusk skin biosorbent Solamen Vaillanti Mollusk Powder as an Efficient Biosorbent for Removing Cobalt Ions from Aqueous Solution: Kinetic and Equilibrium Studies [Volume 11, Issue 1, 2023, Pages 159-169]
Mpro In Silico Approach for Designing Novel SARS-CoV-2 Inhibitors from Medicinal Plants [Volume 11, Issue 3, 2023, Pages 589-604]

N

N Elaboration and Characterization of Organo-Ghassoul (Moroccan Clay) as an Adsorbent Using Cationic Surfactant for Anionic Dye Adsorption [Volume 11, Issue 4, 2023, Pages 913-928]
Nano carbon (CN) Physical Study of PVA Filled with Carbon Nanotube and Nano Carbon with Roughness Morphology [Volume 11, Issue 4, 2023, Pages 747-760]
Nanocomposite Pulsed Plasma-Chemical Synthesis of CuxOy-TiO2 Nanocomposite [Volume 11, Issue 2, 2023, Pages 425-436]
Nanocomposites Insights into the Electronic Properties of Coumarins: A Comparative Study Synthesis and Characterization of Fe2O3/Mn2O3 Magnetic Nanocomposites for the Photocatalytic Degradation of Methylene Blue [Volume 11, Issue 2, 2023, Pages 437-447]
Nanodiopside Optimization of Adsorption Process Parameters of Allura Red Removal Using Nanodiopside/Zn-Fe Layered Double Hydroxide Composite by Response Surface Methodology: A Kinetic, Thermodynamic, and Equilibrium Approach [Volume 11, Issue 1, 2023, Pages 63-78]
Nanofluid The Rheology of Nanolubricants Based on Fe2O3, Al2O3, and ZnO Oxide Nanoparticles: A Comparative Study [Volume 11, Issue 2, 2023, Pages 181-189]
Nanofluid Combined Effects of Inclination Angle and Imposed Flow on Mixed Convective Cooling Inside a Vented Cavity Crossed by Nanofluids [Volume 11, Issue 3, 2023, Pages 631-642]
Nanofluids Volumetric Properties of Nanofluids by a Perturbed Hard-sphere Chain Equation of State [Volume 11, Issue 4, 2023, Pages 735-745]
Nanoparticles The Rheology of Nanolubricants Based on Fe2O3, Al2O3, and ZnO Oxide Nanoparticles: A Comparative Study [Volume 11, Issue 2, 2023, Pages 181-189]
Nanoparticles An Investigation of the Electrophysical Properties of Composite Ceramic Materials Containing Nickel Nanoparticles [Volume 11, Issue 2, 2023, Pages 231-239]
Nanopowder Structural, Optical, and Luminescence Studies of Sm2O3-Doped Cd2Sr(PO4)2 Nanopowder [Volume 11, Issue 3, 2023, Pages 501-510]
Nano-vectorization New Insights in the Use of Boron Nitrogen Nanotubes as Cisplatin Nanovector [Volume 11, Issue 2, 2023, Pages 253-265]
Natural products In Silico Approach for Designing Novel SARS-CoV-2 Inhibitors from Medicinal Plants [Volume 11, Issue 3, 2023, Pages 589-604]
NBO Insights into the Electronic Properties of Coumarins: A Comparative Study Synthesis, Characterization, and Theoretical Study of New Peptides Obtained by Opening Reactions of Sulfahydantoins [Volume 11, Issue 2, 2023, Pages 341-352]
NCI Insights into the Electronic Properties of Coumarins: A Comparative Study Synthesis, Characterization, and Theoretical Study of New Peptides Obtained by Opening Reactions of Sulfahydantoins [Volume 11, Issue 2, 2023, Pages 341-352]
Nitro-PAHs Heat-Refluxextraction (HRE) and GC/MS Analysis of Polycyclic Aromatic Hydrocarbons and Their Nitrted Derivatives Adsorbed on Diesel Combustion Engine Prticles [Volume 11, Issue 2, 2023, Pages 203-219]
N-Methyl-N Elaboration and Characterization of Organo-Ghassoul (Moroccan Clay) as an Adsorbent Using Cationic Surfactant for Anionic Dye Adsorption [Volume 11, Issue 4, 2023, Pages 913-928]
Noble gas Adsorption of Some Gas Molecules on the Surface of Graphene Nanoflakes [Volume 11, Issue 4, 2023, Pages 877-887]
N-trioctyl ammonium chloride Elaboration and Characterization of Organo-Ghassoul (Moroccan Clay) as an Adsorbent Using Cationic Surfactant for Anionic Dye Adsorption [Volume 11, Issue 4, 2023, Pages 913-928]
Nucleobase DFT Study on the Carcinogenicity of some Common Polycyclic Aromatic Hydrocarbons (PAH) [Volume 11, Issue 3, 2023, Pages 537-548]
Nucleophiles Insights into the Electronic Properties of Coumarins: A Comparative Study Synthesis, Characterization, and Theoretical Study of New Peptides Obtained by Opening Reactions of Sulfahydantoins [Volume 11, Issue 2, 2023, Pages 341-352]

O

Opening reaction Insights into the Electronic Properties of Coumarins: A Comparative Study Synthesis, Characterization, and Theoretical Study of New Peptides Obtained by Opening Reactions of Sulfahydantoins [Volume 11, Issue 2, 2023, Pages 341-352]
Optical band gap energy Synthesis of ZnS Nanoparticles via a Sonochemical Method: Photocatalytic Activity and Optical Properties [Volume 11, Issue 3, 2023, Pages 575-587]
Optical properties Physical Study of PVA Filled with Carbon Nanotube and Nano Carbon with Roughness Morphology [Volume 11, Issue 4, 2023, Pages 747-760]
Organic photovoltaic cell First-Principles Study on Optoelectronic and Photovoltaic Properties in a P3HT/PCBM Complex [Volume 11, Issue 2, 2023, Pages 299-313]
Oscillator strength Insights into the Electronic Properties of Coumarins: A Comparative Study [Volume 11, Issue 2, 2023, Pages 267-286]
OSIRIS-MOLINSPIRATION COMPUTATIONAL INVESTIGATION OF GENIPOSIDIC ACID AS AN ANTICANCER AGENT USING MOLECULAR DOCKING, MOLECULAR DYNAMIC SIMULATION, DFT CALCULATION, AND OSIRIS-MOLINSPIRATION PROFILING [Volume 11, Issue 4, 2023, Pages 801-823]
Oxidative desulfurization of condensate Synthesis MnMoP/γ-Al2O3 Oxidative Desulfurization Catalyst and Optimized the Operating Conditions of the Catalytic ODS Method of Condensate [Volume 11, Issue 1, 2023, Pages 49-61]
Oxidative desulfurization of light oil naphtha The Preparation of FeMo/γ-Al2O3 Extruded Catalyst and Optimization of the Operating Conditions of the ODS of Light Oil Naphtha [Volume 11, Issue 2, 2023, Pages 191-202]

P

P3HT First-Principles Study on Optoelectronic and Photovoltaic Properties in a P3HT/PCBM Complex [Volume 11, Issue 2, 2023, Pages 299-313]
PAHs Heat-Refluxextraction (HRE) and GC/MS Analysis of Polycyclic Aromatic Hydrocarbons and Their Nitrted Derivatives Adsorbed on Diesel Combustion Engine Prticles [Volume 11, Issue 2, 2023, Pages 203-219]
Partial molar properties Study of Molecular Interactions of Fossil Fuels through Acoustic and Volumetric Data [Volume 11, Issue 1, 2023, Pages 129-137]
Pb(II) Removal Removal of Pb(II) Ion from Aqueous Solution Using As-synthesized CuO/Cu2O Nanocomposites [Volume 11, Issue 1, 2023, Pages 171-180]
Percolation threshold An Investigation of the Electrophysical Properties of Composite Ceramic Materials Containing Nickel Nanoparticles [Volume 11, Issue 2, 2023, Pages 231-239]
Photocatalysis Performance of a Recirculating Fixed Bed Reactor for the Oxidation of Phenol and Trisubstituted Phenols by Heterogeneous Photocatalytic Process-mechanistic, Kinetic and Substituents Approach [Volume 11, Issue 1, 2023, Pages 79-89]
Photocatalysts Insights into the Electronic Properties of Coumarins: A Comparative Study Synthesis and Characterization of Fe2O3/Mn2O3 Magnetic Nanocomposites for the Photocatalytic Degradation of Methylene Blue [Volume 11, Issue 2, 2023, Pages 437-447]
Photocatalytic activity Photocatalytic Degradation of Rhodamine B and Methylene blue Using α-Fe2O3 Nanoparticles [Volume 11, Issue 1, 2023, Pages 139-147]
Photocatalytic activity Synthesis of ZnS Nanoparticles via a Sonochemical Method: Photocatalytic Activity and Optical Properties [Volume 11, Issue 3, 2023, Pages 575-587]
Photo-Fenton Process Performance of a Recirculating Fixed Bed Reactor for the Oxidation of Phenol and Trisubstituted Phenols by Heterogeneous Photocatalytic Process-mechanistic, Kinetic and Substituents Approach [Volume 11, Issue 1, 2023, Pages 79-89]
Photoluminescence Enhanced Luminescence and Energy Transfer of Bi3+/Dy3+ Co-doped La2Zr2O7 Nanophosphors for pc-LED Applications [Volume 11, Issue 1, 2023, Pages 23-31]
Piperazine Molecular Structure, Linear, and Nonlinear Optical Properties of Piperazine-1,4-Diium Bis 2,4,6-Trinitrophenolate: A Theoretical Investigation [Volume 11, Issue 1, 2023, Pages 33-48]
Plasma working gases A Numerical Investigation of the Thermal Transport Properties of Argon + Hydrogen Plasma Working Gases in the Presence of Various TiO2 Precursor Solutions [Volume 11, Issue 4, 2023, Pages 897-912]
Plastic degradation Photo-physical and Morphological Study of Polymers: A Review [Volume 11, Issue 2, 2023, Pages 409-424]
Poly(4-vinylpyridine) Neutralization Degree Effect on Potentiometric Behavior of Poly(N-octyl-4-vinylpyridinium Bromide) [Volume 11, Issue 1, 2023, Pages 91-101]
Poly(4-vinylpyridine) (P4VP) Enhanced Removal of Brilliant Orange by Poly(4-vinylpyridine)/Acid-Activated Bentonite Composite [Volume 11, Issue 2, 2023, Pages 327-339]
Poly(N-octyl-4-vinylpyridiniumbromide) Neutralization Degree Effect on Potentiometric Behavior of Poly(N-octyl-4-vinylpyridinium Bromide) [Volume 11, Issue 1, 2023, Pages 91-101]
Poly(vinyl alcohol) Physical Study of PVA Filled with Carbon Nanotube and Nano Carbon with Roughness Morphology [Volume 11, Issue 4, 2023, Pages 747-760]
Polyvinyl alcohol (PVA) Nano-based Biodegradable Food Packaging of Vitis-Vinifera Synthesized by PVA/ZnO Nanocomposites [Volume 11, Issue 2, 2023, Pages 449-458]
Poly (vinyl chloride) Photo-physical and Morphological Study of Polymers: A Review [Volume 11, Issue 2, 2023, Pages 409-424]
Porphyrin In Silico Study of the Effect of Porphyrin-Based Ligands on the Structure of G-Quadruplex in the Presence of Different Ions [Volume 11, Issue 4, 2023, Pages 695-705]
Potassium permanganate Comparative Kinetic Study of Palladium(II) Catalyzed and Uncatalyzed Oxidation of Ambroxol Hydrochloride with Potassium Permanganate in an Aqueous Alkaline Medium: A Mechanistic Approach [Volume 11, Issue 4, 2023, Pages 865-875]
Promoter Deactivation of Iron Fischer-Tropsch Catalyst in the Presence of Different Promoters: Model Determination and Parameter Estimation Using a Hybrid ANN/GPLE Technique [Volume 11, Issue 4, 2023, Pages 761-770]
Pulsed plasma-chemical synthesis Pulsed Plasma-Chemical Synthesis of CuxOy-TiO2 Nanocomposite [Volume 11, Issue 2, 2023, Pages 425-436]
PVC recycling Photo-physical and Morphological Study of Polymers: A Review [Volume 11, Issue 2, 2023, Pages 409-424]

Q

QSAR Structural Insight into 2-Aryl-4-Quinoline Carboxylic Acid-Based Dihydroorotate Dehydrogenase (DHODH) and its Potential Anti-SARS-CoV-2 Activity Through Pharmacophore Modeling, Multidimensional QSAR, ADME, and Docking Studies [Volume 11, Issue 4, 2023, Pages 783-800]
QTAIM Molecular Analysis of Potential Inhibitors Against SARS-CoV-2: Computational Approach [Volume 11, Issue 4, 2023, Pages 725-734]
Quantum Chemistry Interaction of Electronically Excited CO(a^3 Π_r) Molecules with H, H2, and H2O: Potential Energy Surfaces and Reaction Kinetics [Volume 11, Issue 4, 2023, Pages 837-851]
Quaternization rate Neutralization Degree Effect on Potentiometric Behavior of Poly(N-octyl-4-vinylpyridinium Bromide) [Volume 11, Issue 1, 2023, Pages 91-101]

R

Ranking indices Towards Screening and Repurposing of Approved Drugs for the Treatment of COVID-19 Using Molecular Docking [Volume 11, Issue 4, 2023, Pages 707-723]
Recirculating flow reactor Performance of a Recirculating Fixed Bed Reactor for the Oxidation of Phenol and Trisubstituted Phenols by Heterogeneous Photocatalytic Process-mechanistic, Kinetic and Substituents Approach [Volume 11, Issue 1, 2023, Pages 79-89]
Recyclability Removal of Formaldehyde from Aqueous Solution Using Low-cost and Reusable Adsorbents [Volume 11, Issue 4, 2023, Pages 853-864]
Recycling Methods of Recycling Expanded Polystyrene Waste: Synthesis and Characterization [Volume 11, Issue 4, 2023, Pages 943-951]
Repurposing Towards Screening and Repurposing of Approved Drugs for the Treatment of COVID-19 Using Molecular Docking [Volume 11, Issue 4, 2023, Pages 707-723]
Response Surface Optimization of Adsorption Process Parameters of Allura Red Removal Using Nanodiopside/Zn-Fe Layered Double Hydroxide Composite by Response Surface Methodology: A Kinetic, Thermodynamic, and Equilibrium Approach [Volume 11, Issue 1, 2023, Pages 63-78]
RhB and MB dyes Photocatalytic Degradation of Rhodamine B and Methylene blue Using α-Fe2O3 Nanoparticles [Volume 11, Issue 1, 2023, Pages 139-147]
Rheological behaviour The Rheology of Nanolubricants Based on Fe2O3, Al2O3, and ZnO Oxide Nanoparticles: A Comparative Study [Volume 11, Issue 2, 2023, Pages 181-189]
Rice Husk Ash Structural, Morphological and Physiochemical Analysis of SiC8H20O4/C2H5O/C7H16 Modified Mesoporous Silica Aerogels [Volume 11, Issue 1, 2023, Pages 1-8]
Rotational relaxation Influence of Nanoscopic Micellar Confinements and Rotational Dynamics of Anticancer Drug Doxorubicin [Volume 11, Issue 3, 2023, Pages 471-479]

S

SARS-CoV-2 In-Silico Molecular Docking, Validation, Drug-Likeness, and ADMET Studies of Antiandrogens to Use in the Fight against SARS-CoV-2 [Volume 11, Issue 1, 2023, Pages 9-21]
SARS-CoV-2 In Silico Approach for Designing Novel SARS-CoV-2 Inhibitors from Medicinal Plants [Volume 11, Issue 3, 2023, Pages 589-604]
SARS-CoV-2 Molecular Analysis of Potential Inhibitors Against SARS-CoV-2: Computational Approach [Volume 11, Issue 4, 2023, Pages 725-734]
Selective acylation Synthesis, Antifungal Activity, and Molecular Docking Studies of Some New Di-O-Isopentanoyl Glucopyranosides [Volume 11, Issue 1, 2023, Pages 149-157]
SEM Bio-sorption of As(V) from Aqueous Solutions by Thuja Occidentalis Leaves Activated Carbon@Al Embedded Material [Volume 11, Issue 2, 2023, Pages 287-297]
Silica Aerogel Structural, Morphological and Physiochemical Analysis of SiC8H20O4/C2H5O/C7H16 Modified Mesoporous Silica Aerogels [Volume 11, Issue 1, 2023, Pages 1-8]
Sodium Hydroxide Comparative Kinetic Study of Palladium(II) Catalyzed and Uncatalyzed Oxidation of Ambroxol Hydrochloride with Potassium Permanganate in an Aqueous Alkaline Medium: A Mechanistic Approach [Volume 11, Issue 4, 2023, Pages 865-875]
Sol-gel method Structural, Morphological and Physiochemical Analysis of SiC8H20O4/C2H5O/C7H16 Modified Mesoporous Silica Aerogels [Volume 11, Issue 1, 2023, Pages 1-8]
Solid State Reaction Structural, Optical, and Luminescence Studies of Sm2O3-Doped Cd2Sr(PO4)2 Nanopowder [Volume 11, Issue 3, 2023, Pages 501-510]
Solubility Solubility of Lamotrigine in Polyethylene Glycol 400 + 2-Propanol Mixtures at Different Temperatures [Volume 11, Issue 3, 2023, Pages 675-682]
Solution precursor plasma spraying A Numerical Investigation of the Thermal Transport Properties of Argon + Hydrogen Plasma Working Gases in the Presence of Various TiO2 Precursor Solutions [Volume 11, Issue 4, 2023, Pages 897-912]
Solvent effect Insights into the Electronic Properties of Coumarins: A Comparative Study [Volume 11, Issue 2, 2023, Pages 267-286]
Sonochemical Synthesis of ZnS Nanoparticles via a Sonochemical Method: Photocatalytic Activity and Optical Properties [Volume 11, Issue 3, 2023, Pages 575-587]
Soot Heat-Refluxextraction (HRE) and GC/MS Analysis of Polycyclic Aromatic Hydrocarbons and Their Nitrted Derivatives Adsorbed on Diesel Combustion Engine Prticles [Volume 11, Issue 2, 2023, Pages 203-219]
Spike and NSP proteins Towards Screening and Repurposing of Approved Drugs for the Treatment of COVID-19 Using Molecular Docking [Volume 11, Issue 4, 2023, Pages 707-723]
Spike protein In Silico Approach for Designing Novel SARS-CoV-2 Inhibitors from Medicinal Plants [Volume 11, Issue 3, 2023, Pages 589-604]
Sr-doped α-MnO2 nanowires The Effect of Sr-Doping on Structural, Optical, Catalytic, and Photocatalytic Properties of α-MnO2 Nanowires Synthesized via a Hydrothermal Route [Volume 11, Issue 3, 2023, Pages 559-574]
Stability Deactivation of Iron Fischer-Tropsch Catalyst in the Presence of Different Promoters: Model Determination and Parameter Estimation Using a Hybrid ANN/GPLE Technique [Volume 11, Issue 4, 2023, Pages 761-770]
Stabilizers Photo-physical and Morphological Study of Polymers: A Review [Volume 11, Issue 2, 2023, Pages 409-424]
Stabilizing capacity Insights into the Lignin Dissolution Mechanism of Water Content Tailored-choline Chloride (ChCl) Based Green Solvents for Biomass Pretreatment [Volume 11, Issue 3, 2023, Pages 605-614]
Strontium Structural, Optical, and Luminescence Studies of Sm2O3-Doped Cd2Sr(PO4)2 Nanopowder [Volume 11, Issue 3, 2023, Pages 501-510]
Structural and optical properties The Effect of Sr-Doping on Structural, Optical, Catalytic, and Photocatalytic Properties of α-MnO2 Nanowires Synthesized via a Hydrothermal Route [Volume 11, Issue 3, 2023, Pages 559-574]
Structural features Structural Insight into 2-Aryl-4-Quinoline Carboxylic Acid-Based Dihydroorotate Dehydrogenase (DHODH) and its Potential Anti-SARS-CoV-2 Activity Through Pharmacophore Modeling, Multidimensional QSAR, ADME, and Docking Studies [Volume 11, Issue 4, 2023, Pages 783-800]
Suction Combined Effects of Inclination Angle and Imposed Flow on Mixed Convective Cooling Inside a Vented Cavity Crossed by Nanofluids [Volume 11, Issue 3, 2023, Pages 631-642]
Sulfahydantoin Insights into the Electronic Properties of Coumarins: A Comparative Study Synthesis, Characterization, and Theoretical Study of New Peptides Obtained by Opening Reactions of Sulfahydantoins [Volume 11, Issue 2, 2023, Pages 341-352]
Sulfonation Methods of Recycling Expanded Polystyrene Waste: Synthesis and Characterization [Volume 11, Issue 4, 2023, Pages 943-951]
Sulfuryl chloride Reactivity of Isothiasole with Dibromine and Sulfuryl Chloride [Volume 11, Issue 3, 2023, Pages 511-525]

T

TC55 composite Enhanced Removal of Brilliant Orange by Poly(4-vinylpyridine)/Acid-Activated Bentonite Composite [Volume 11, Issue 2, 2023, Pages 327-339]
TD-DFT First-Principles Study on Optoelectronic and Photovoltaic Properties in a P3HT/PCBM Complex [Volume 11, Issue 2, 2023, Pages 299-313]
TD-DFT calculations Insights into the Electronic Properties of Coumarins: A Comparative Study [Volume 11, Issue 2, 2023, Pages 267-286]
TEM Comparative Study of Crystallite Size from XRD and TEM Results for Pure and V2O5 Doped CdO-FePO4 Composite Nanopowders [Volume 11, Issue 2, 2023, Pages 241-251]
Temperature dependence An Investigation of the Electrophysical Properties of Composite Ceramic Materials Containing Nickel Nanoparticles [Volume 11, Issue 2, 2023, Pages 231-239]
Thermal conductivity A Numerical Investigation of the Thermal Transport Properties of Argon + Hydrogen Plasma Working Gases in the Presence of Various TiO2 Precursor Solutions [Volume 11, Issue 4, 2023, Pages 897-912]
Thermal decomposition Photocatalytic Degradation of Rhodamine B and Methylene blue Using α-Fe2O3 Nanoparticles [Volume 11, Issue 1, 2023, Pages 139-147]
Thermal stability Methods of Recycling Expanded Polystyrene Waste: Synthesis and Characterization [Volume 11, Issue 4, 2023, Pages 943-951]
Thermodynamic Adsorption of Vanadium Using Amberlite IRA-68 Resin from Aqueous Solution: Kinetics and Thermodynamics Studies [Volume 11, Issue 4, 2023, Pages 929-942]
Thermodynamic Modeling Measurement and Thermodynamic Modeling of LLE Data of Ternary System (Water + Caproic Acid + Undecan-1-ol) at 298.2 K [Volume 11, Issue 3, 2023, Pages 615-622]
Thermodynamic Models Study of Phase Equilibria for the n-Butane + Methanol System from 323.22 K to 423.09 K [Volume 11, Issue 1, 2023, Pages 103-116]
Thermodynamic properties Adsorption of an Azo Dye on Graphene Nanosheet: A Molecular Dynamics Simulation Study [Volume 11, Issue 1, 2023, Pages 117-127]
Thiazole Identification of a Potential Thiazole Inhibitor Against Biofilms by 3D QSAR, Molecular Docking, DFT Analysis, MM-PBSA Binding Energy Calculations, and Molecular Dynamics Simulation [Volume 11, Issue 2, 2023, Pages 369-389]
TiO2 nanoparticles Synthesis of TiO2 Nanoparticles by Hydrothermal Method and Characterization of their Antibacterial Activity: Investigation of the Impact of Magnetism on the Photocatalytic Properties of the Nanoparticles [Volume 11, Issue 4, 2023, Pages 771-782]
Titanium dioxide Pulsed Plasma-Chemical Synthesis of CuxOy-TiO2 Nanocomposite [Volume 11, Issue 2, 2023, Pages 425-436]
TMPRSS2 In-Silico Molecular Docking, Validation, Drug-Likeness, and ADMET Studies of Antiandrogens to Use in the Fight against SARS-CoV-2 [Volume 11, Issue 1, 2023, Pages 9-21]
TOLC@Al Bio-sorption of As(V) from Aqueous Solutions by Thuja Occidentalis Leaves Activated Carbon@Al Embedded Material [Volume 11, Issue 2, 2023, Pages 287-297]
Treated clay (TC) Enhanced Removal of Brilliant Orange by Poly(4-vinylpyridine)/Acid-Activated Bentonite Composite [Volume 11, Issue 2, 2023, Pages 327-339]
TRPV1antagonist Prediction of Novel TRPV1 Antagonist: A Combination of 3D-QSAR, Molecular Docking, MD Simulations and ADMET Prediction [Volume 11, Issue 2, 2023, Pages 353-368]
Tuberculosis Discovery of New Inhibitors of Enoyl-ACP Reductase via Structure-Based Virtual Screening [Volume 11, Issue 3, 2023, Pages 459-469]

U

Undecan-1-ol Measurement and Thermodynamic Modeling of LLE Data of Ternary System (Water + Caproic Acid + Undecan-1-ol) at 298.2 K [Volume 11, Issue 3, 2023, Pages 615-622]
Uricase An Approach to Increase the Efficiency of Uricase by Computational Mutagenesis [Volume 11, Issue 3, 2023, Pages 481-491]
Uricase A Computational Investigation on Immunogenicity of Uricase from Aspergillus Flavus and Candida Utilis [Volume 11, Issue 3, 2023, Pages 683-693]

V

V2O5 Comparative Study of Crystallite Size from XRD and TEM Results for Pure and V2O5 Doped CdO-FePO4 Composite Nanopowders [Volume 11, Issue 2, 2023, Pages 241-251]
Vanadium adsorption Adsorption of Vanadium Using Amberlite IRA-68 Resin from Aqueous Solution: Kinetics and Thermodynamics Studies [Volume 11, Issue 4, 2023, Pages 929-942]
Vented cavity Combined Effects of Inclination Angle and Imposed Flow on Mixed Convective Cooling Inside a Vented Cavity Crossed by Nanofluids [Volume 11, Issue 3, 2023, Pages 631-642]
Vibrational frequency Quantum Calculations of some Electronic and Structural Parameters for the System of Vitamin C and Different Sulfoxide Solvents [Volume 11, Issue 3, 2023, Pages 643-651]
Virtual screening Discovery of New Inhibitors of Enoyl-ACP Reductase via Structure-Based Virtual Screening [Volume 11, Issue 3, 2023, Pages 459-469]
Viscosity The Rheology of Nanolubricants Based on Fe2O3, Al2O3, and ZnO Oxide Nanoparticles: A Comparative Study [Volume 11, Issue 2, 2023, Pages 181-189]
Viscosity and Activation energy of viscous flow Thermophysical Study of Ethylene Glycol + H2O and Ethylene Glycol + (DMF/H2O) at 298.15 K [Volume 11, Issue 4, 2023, Pages 889-896]
Vitis-vinifera Nano-based Biodegradable Food Packaging of Vitis-Vinifera Synthesized by PVA/ZnO Nanocomposites [Volume 11, Issue 2, 2023, Pages 449-458]
VLE Study of Phase Equilibria for the n-Butane + Methanol System from 323.22 K to 423.09 K [Volume 11, Issue 1, 2023, Pages 103-116]

W

Wastewater Removal of Formaldehyde from Aqueous Solution Using Low-cost and Reusable Adsorbents [Volume 11, Issue 4, 2023, Pages 853-864]
W-H method Comparative Study of Crystallite Size from XRD and TEM Results for Pure and V2O5 Doped CdO-FePO4 Composite Nanopowders [Volume 11, Issue 2, 2023, Pages 241-251]

X

XRD Comparative Study of Crystallite Size from XRD and TEM Results for Pure and V2O5 Doped CdO-FePO4 Composite Nanopowders [Volume 11, Issue 2, 2023, Pages 241-251]
XRD Synthesis of TiO2 Nanoparticles by Hydrothermal Method and Characterization of their Antibacterial Activity: Investigation of the Impact of Magnetism on the Photocatalytic Properties of the Nanoparticles [Volume 11, Issue 4, 2023, Pages 771-782]

Z

ZnS Synthesis of ZnS Nanoparticles via a Sonochemical Method: Photocatalytic Activity and Optical Properties [Volume 11, Issue 3, 2023, Pages 575-587]

Keyword Index

A

B

C

D

E

F

G

H

I

K

L

M

N

O

P

Q

R

S

T

U

V

W

X

Z