A
-
Acetylcholinesterase
Benzimidazole Derivatives in Identifying Novel Acetylcholinesterase Inhibitors: A Combination of 3D-QSAR, Docking and Molecular Dynamics Simulation [Volume 10, Issue 2, 2022, Pages 237-249]
-
Acetylcholinesterase (AChE)
Docking and 2D-Structure-activity Relationship and ADMET Studies of Acetylcholinesterase Inhibitors [Volume 10, Issue 1, 2022, Pages 31-44]
-
Activated clay
Graphene Oxide/Activated Clay/Gelatin Composites: Synthesis, Characterization and Properties [Volume 10, Issue 1, 2022, Pages 143-150]
-
ADMET
Docking and 2D-Structure-activity Relationship and ADMET Studies of Acetylcholinesterase Inhibitors [Volume 10, Issue 1, 2022, Pages 31-44]
-
ADMET
Combined 3D-QSAR and Molecular Docking Analysis of Styrylquinoline Derivatives as Potent anti-cancer Agents [Volume 10, Issue 3, 2022, Pages 345-362]
-
ADMET
In Silico Prediction of Novel (TRIM24) Bromodomain Inhibitors: A Combination of 3D-QSAR, Molecular Docking, ADMET Prediction, and Molecular Dynamics Simulation [Volume 10, Issue 4, 2022, Pages 519-535]
-
Adsorption
Adsorption of the Methylene Blue Dye in Environmental Water Samples by Biochar Obtained from the Valorization of Argan Shells [Volume 10, Issue 3, 2022, Pages 301-313]
-
Adsorption Isotherm
Thermodynamic, Kinetic, Batch Adsorption and Isotherm Models for the Adsorption of Nickel from an Artificial Solution Using Chloroxylon Swietenia Activated Carbon [Volume 10, Issue 3, 2022, Pages 315-324]
-
AFM
Synthesized of Novel Imidazole-derived Schiff Base as a Corrosion Inhibitor of Carbon Steel in Acidic Medium Supported by Electrochemical and DFT Studies [Volume 10, Issue 2, 2022, Pages 179-194]
-
Alzheimer
Calculation of Structural Parameters and Diffusion Coefficient of Sodium Dodecyl Sulfate at Concentrations Lower and Higher Than the Critical Micelle Concentration in the Presence of Amyloid-Beta Peptide [Volume 10, Issue 4, 2022, Pages 571-579]
-
Alzheimer’s disease
Benzimidazole Derivatives in Identifying Novel Acetylcholinesterase Inhibitors: A Combination of 3D-QSAR, Docking and Molecular Dynamics Simulation [Volume 10, Issue 2, 2022, Pages 237-249]
-
Amines
Excess Speed of Sound and Excess Molar Isentropic Compressibility in Binary Mixtures of Selected Amines in 2-Methoxy Ethanol at Various Temperatures [Volume 10, Issue 3, 2022, Pages 379-390]
-
Anthocyanins
Study on the Molecular Interaction of Anthocyanin-rich Eggplant Extracts with Bovine α-Lactalbumin [Volume 10, Issue 4, 2022, Pages 485-494]
-
Anticancer properties
An Exploration of the Antiproliferative Potential of Chalcones and Dihydropyrazole Derivatives in Prostate Cancer via Androgen Receptor: Combined QSAR, Machine Learning, and Molecular Docking Techniques [Volume 10, Issue 2, 2022, Pages 211-223]
-
Antifungal
Modified Thymidine Derivatives as Potential Inhibitors of SARS-CoV: PASS, In Vitro Antimicrobial, Physicochemical and Molecular Docking Studies [Volume 10, Issue 3, 2022, Pages 391-409]
-
Argan shells
Adsorption of the Methylene Blue Dye in Environmental Water Samples by Biochar Obtained from the Valorization of Argan Shells [Volume 10, Issue 3, 2022, Pages 301-313]
-
AZ
Theoretical Investigation on Inclusion Complex of (s)-2-Isopropyl-1-(o-nitrophenyl) Sulfonyl) Aziridine with β-Cyclodextrin [Volume 10, Issue 1, 2022, Pages 69-87]
-
Azo dye
Treatment and Degradation of Azo Dye Waste Industry by Electro-Fenton Process [Volume 10, Issue 4, 2022, Pages 495-504]
B
-
B12P12
The Effects of the Ionic Field Strength of Be2+, Mg2+, and Ca2+ and a Static Electric Field (SEF) on the Interaction Between Prothionamide and B12P12 Nanocage: A DFT and TD-DFT Study [Volume 10, Issue 1, 2022, Pages 89-104]
-
Benzimidazole
Benzimidazole Derivatives in Identifying Novel Acetylcholinesterase Inhibitors: A Combination of 3D-QSAR, Docking and Molecular Dynamics Simulation [Volume 10, Issue 2, 2022, Pages 237-249]
-
Beta-Carotene
Quality Parameters, Empirical and Kinetic Models of Lycopene and Beta-carotene Bioformation in Tomatoes (Solanum lycopersicum) [Volume 10, Issue 1, 2022, Pages 151-162]
-
BET isotherm
The Modification of the BET Surface Area by Considering the Excluded Area of Adsorbed Molecules [Volume 10, Issue 2, 2022, Pages 173-177]
-
Bioactivity
The Effects of Silicon Oxide on the Structure, Physical Chemistry Properties, and Bioactivity of Phosphate Glasses Containing Sodium, Strontium, and Titanium Oxides [Volume 10, Issue 1, 2022, Pages 1-12]
-
Biochar
Adsorption of the Methylene Blue Dye in Environmental Water Samples by Biochar Obtained from the Valorization of Argan Shells [Volume 10, Issue 3, 2022, Pages 301-313]
-
Biopolymer
Graphene Oxide/Activated Clay/Gelatin Composites: Synthesis, Characterization and Properties [Volume 10, Issue 1, 2022, Pages 143-150]
-
Black fungus
Modified D-Glucofuranoses as New Black Fungus Protease Inhibitors: Computational Screening, Docking, Dynamics, and QSAR Study [Volume 10, Issue 2, 2022, Pages 195-209]
-
Borate glasses
XRD, EPR and FT-IR Studies of Zinc Aluminium Lithium Borate (ZALB) Glases Doped with Cu2+ Ions [Volume 10, Issue 4, 2022, Pages 455-460]
C
-
Catalyst inhibitor complex
An Inhibitory Kinetic Method for the Methionine Determination [Volume 10, Issue 2, 2022, Pages 283-292]
-
Chitosan
Preparation of Schiff Bases Derived from Chitosan and Investigate their Photostability and Thermal Stability [Volume 10, Issue 4, 2022, Pages 549-557]
-
Chloroxylon Swietenia Activated Carbon (CSAC)
Thermodynamic, Kinetic, Batch Adsorption and Isotherm Models for the Adsorption of Nickel from an Artificial Solution Using Chloroxylon Swietenia Activated Carbon [Volume 10, Issue 3, 2022, Pages 315-324]
-
Choline chloride
Deep Eutectic Solvent as a Green Solvent for Fast Analysis of the Volatile Components of Satureja Hortensis L. [Volume 10, Issue 3, 2022, Pages 421-428]
-
Clausius-Mossotti equation
Dielectric Properties of Ultra-Low Dielectric Constant PVA-Pentaerythritol/MnO2 Nanocomposite [Volume 10, Issue 3, 2022, Pages 325-331]
-
CoMFA
Combined 3D-QSAR and Molecular Docking Analysis of Styrylquinoline Derivatives as Potent anti-cancer Agents [Volume 10, Issue 3, 2022, Pages 345-362]
-
Composite
Graphene Oxide/Activated Clay/Gelatin Composites: Synthesis, Characterization and Properties [Volume 10, Issue 1, 2022, Pages 143-150]
-
Computational chemistry
Benzimidazole Derivatives in Identifying Novel Acetylcholinesterase Inhibitors: A Combination of 3D-QSAR, Docking and Molecular Dynamics Simulation [Volume 10, Issue 2, 2022, Pages 237-249]
-
Computational investigation
Density Functional Theory Study of the Reaction Behavior Histidine Modified Polyamidoamine Dendrimer as Nanocarrier for Delivery of Ectoine Drug [Volume 10, Issue 2, 2022, Pages 225-236]
-
CoMSIA
Combined 3D-QSAR and Molecular Docking Analysis of Styrylquinoline Derivatives as Potent anti-cancer Agents [Volume 10, Issue 3, 2022, Pages 345-362]
-
Co-precipitation method
Effect of PVA/PEG-coated Fe3O4 Nanoparticles on the Structure, Morphology and Magnetic Properties [Volume 10, Issue 4, 2022, Pages 537-547]
-
Cross-Linking
Density Functional Theory Study of the Reaction Behavior Histidine Modified Polyamidoamine Dendrimer as Nanocarrier for Delivery of Ectoine Drug [Volume 10, Issue 2, 2022, Pages 225-236]
-
Curcuma longa
An In Vivo Synergistic Research on the Assessment of the Phytocompound Capped Silver Nanoparticles from Raphanus sativus Leaf Extract and Curcuma longa Against UTI-Causing E.coli. [Volume 10, Issue 4, 2022, Pages 581-588]
-
Cyclic Voltammetry
Voltammetric and Spectroscopic Studies of Memantine Hydrochloride and its Transition Metal Complexes [Volume 10, Issue 1, 2022, Pages 13-21]
D
-
Decomposition
Spherical α Fe2O3 Nanoparticles: Synthesis and Characterization and Its Photocatalytic Degradation of Methyl Orange and Methylene Blue [Volume 10, Issue 4, 2022, Pages 473-483]
-
Decomposition kinetics
Kinetic Analysis of Hydrolytic Decomposition of Rubrocurcumin Analogues [Volume 10, Issue 2, 2022, Pages 251-265]
-
Deep eutectic solvents
Deep Eutectic Solvent as a Green Solvent for Fast Analysis of the Volatile Components of Satureja Hortensis L. [Volume 10, Issue 3, 2022, Pages 421-428]
-
Density
Density, Refractive Index, and Electrical Conductivity of Ternary Mixtures Containing 1,3-Butanediol + Sulfolane (TMS) + Perchlorate Salts at Different Temperatures and Atmospheric Pressure [Volume 10, Issue 3, 2022, Pages 363-378]
-
Density
Excess Speed of Sound and Excess Molar Isentropic Compressibility in Binary Mixtures of Selected Amines in 2-Methoxy Ethanol at Various Temperatures [Volume 10, Issue 3, 2022, Pages 379-390]
-
DFT
Theoretical Investigation on Inclusion Complex of (s)-2-Isopropyl-1-(o-nitrophenyl) Sulfonyl) Aziridine with β-Cyclodextrin [Volume 10, Issue 1, 2022, Pages 69-87]
-
DFT
The Effects of the Ionic Field Strength of Be2+, Mg2+, and Ca2+ and a Static Electric Field (SEF) on the Interaction Between Prothionamide and B12P12 Nanocage: A DFT and TD-DFT Study [Volume 10, Issue 1, 2022, Pages 89-104]
-
DFT
Synthesized of Novel Imidazole-derived Schiff Base as a Corrosion Inhibitor of Carbon Steel in Acidic Medium Supported by Electrochemical and DFT Studies [Volume 10, Issue 2, 2022, Pages 179-194]
-
DFT
Experimental and Theoretical Spectroscopic Studies of the Electronic Structure of 2-Ethyl-2-phenylmalonamide [Volume 10, Issue 3, 2022, Pages 333-344]
-
Discoloration
Treatment and Degradation of Azo Dye Waste Industry by Electro-Fenton Process [Volume 10, Issue 4, 2022, Pages 495-504]
-
DRS
Structural, Morphological, and Optical Studies of ZnS-MoS2 Nanocomposite via Hydrothermal Route [Volume 10, Issue 2, 2022, Pages 293-300]
-
Drug Delivery
Density Functional Theory Study of the Reaction Behavior Histidine Modified Polyamidoamine Dendrimer as Nanocarrier for Delivery of Ectoine Drug [Volume 10, Issue 2, 2022, Pages 225-236]
-
Dye-sensitized solar cells
Effect of Temperature and Electrode Thickness on the Performance of Dye-Sensitized Solar Cells [Volume 10, Issue 1, 2022, Pages 23-30]
E
-
Electrode
Effect of Temperature and Electrode Thickness on the Performance of Dye-Sensitized Solar Cells [Volume 10, Issue 1, 2022, Pages 23-30]
-
Electrode material
Treatment and Degradation of Azo Dye Waste Industry by Electro-Fenton Process [Volume 10, Issue 4, 2022, Pages 495-504]
-
Electro-Fenton Process
Treatment and Degradation of Azo Dye Waste Industry by Electro-Fenton Process [Volume 10, Issue 4, 2022, Pages 495-504]
-
Electrostatic potential. Average Local Ionization Energy
Computational Study of the Correlation of in-vitro Antiviral Activities Against SARS-CoV-2 with Different Theoretical Descriptors [Volume 10, Issue 3, 2022, Pages 429-438]
-
Empirical Modeling
Quality Parameters, Empirical and Kinetic Models of Lycopene and Beta-carotene Bioformation in Tomatoes (Solanum lycopersicum) [Volume 10, Issue 1, 2022, Pages 151-162]
-
Encapsulated ions
The Effects of the Ionic Field Strength of Be2+, Mg2+, and Ca2+ and a Static Electric Field (SEF) on the Interaction Between Prothionamide and B12P12 Nanocage: A DFT and TD-DFT Study [Volume 10, Issue 1, 2022, Pages 89-104]
-
Enhanced oil recovery
Measuring Interfacial Tension Between Oil and Nano-Saline Solutions in the Presence of SiO2 or TiO2 at Low and Intermediate Pressures [Volume 10, Issue 2, 2022, Pages 163-171]
-
Enthalpy
Physicochemical Properties and Structural Analysis of Some Organic Solvent (OS)-Water Systems: A Quantum Mechanical Study [Volume 10, Issue 4, 2022, Pages 559-570]
-
EPR
XRD, EPR and FT-IR Studies of Zinc Aluminium Lithium Borate (ZALB) Glases Doped with Cu2+ Ions [Volume 10, Issue 4, 2022, Pages 455-460]
-
Equation of state
On the Effect of the Hard-sphere Term on the Statistical Associating Fluid Theory Equation of State [Volume 10, Issue 1, 2022, Pages 45-56]
-
Eutectic point
Evaluation of the Thermal Properties of Ternary Mixtures of Fatty Acids for Green Thermal Energy Storage Application [Volume 10, Issue 4, 2022, Pages 461-471]
-
Excipients
An Inhibitory Kinetic Method for the Methionine Determination [Volume 10, Issue 2, 2022, Pages 283-292]
-
Excluded area
The Modification of the BET Surface Area by Considering the Excluded Area of Adsorbed Molecules [Volume 10, Issue 2, 2022, Pages 173-177]
-
Excluded volume
The Modification of the BET Surface Area by Considering the Excluded Area of Adsorbed Molecules [Volume 10, Issue 2, 2022, Pages 173-177]
-
Extreme learning machine
An Exploration of the Antiproliferative Potential of Chalcones and Dihydropyrazole Derivatives in Prostate Cancer via Androgen Receptor: Combined QSAR, Machine Learning, and Molecular Docking Techniques [Volume 10, Issue 2, 2022, Pages 211-223]
F
-
Fe3O4 nanoparticles
Effect of PVA/PEG-coated Fe3O4 Nanoparticles on the Structure, Morphology and Magnetic Properties [Volume 10, Issue 4, 2022, Pages 537-547]
-
Fluorescence spectroscopy
Study on the Molecular Interaction of Anthocyanin-rich Eggplant Extracts with Bovine α-Lactalbumin [Volume 10, Issue 4, 2022, Pages 485-494]
-
Free energy
Physicochemical Properties and Structural Analysis of Some Organic Solvent (OS)-Water Systems: A Quantum Mechanical Study [Volume 10, Issue 4, 2022, Pages 559-570]
-
Free volume
A Study of Some Excess Thermodynamic Properties in Binary Mixtures of Non-Aqueous Solvents at Variable Temperatures [Volume 10, Issue 3, 2022, Pages 439-453]
-
FT-IR
Structural, Morphological, and Optical Studies of ZnS-MoS2 Nanocomposite via Hydrothermal Route [Volume 10, Issue 2, 2022, Pages 293-300]
-
FT-IR
Experimental and Theoretical Spectroscopic Studies of the Electronic Structure of 2-Ethyl-2-phenylmalonamide [Volume 10, Issue 3, 2022, Pages 333-344]
-
FT-IR spectroscopy
XRD, EPR and FT-IR Studies of Zinc Aluminium Lithium Borate (ZALB) Glases Doped with Cu2+ Ions [Volume 10, Issue 4, 2022, Pages 455-460]
-
FT-Raman
Experimental and Theoretical Spectroscopic Studies of the Electronic Structure of 2-Ethyl-2-phenylmalonamide [Volume 10, Issue 3, 2022, Pages 333-344]
G
-
GCMS
An In Vivo Synergistic Research on the Assessment of the Phytocompound Capped Silver Nanoparticles from Raphanus sativus Leaf Extract and Curcuma longa Against UTI-Causing E.coli. [Volume 10, Issue 4, 2022, Pages 581-588]
-
Gelatin
Graphene Oxide/Activated Clay/Gelatin Composites: Synthesis, Characterization and Properties [Volume 10, Issue 1, 2022, Pages 143-150]
-
Geranyl geranyl pyrophosphate
Quality Parameters, Empirical and Kinetic Models of Lycopene and Beta-carotene Bioformation in Tomatoes (Solanum lycopersicum) [Volume 10, Issue 1, 2022, Pages 151-162]
-
Glass
The Effects of Silicon Oxide on the Structure, Physical Chemistry Properties, and Bioactivity of Phosphate Glasses Containing Sodium, Strontium, and Titanium Oxides [Volume 10, Issue 1, 2022, Pages 1-12]
-
Granular Materials
Activated Empty Palm Fruit Bunch for the Adsorption of Heavy Metal Ions: Kinetics and Thermodynamics [Volume 10, Issue 4, 2022, Pages 505-518]
H
-
H2O
Physicochemical Properties and Structural Analysis of Some Organic Solvent (OS)-Water Systems: A Quantum Mechanical Study [Volume 10, Issue 4, 2022, Pages 559-570]
-
Hand
Liquid-liquid Equilibrium Data of Aqueous Mixtures of Butyric Acid with 2-Methylcyclohexanol at Different Temperatures and 102.1 kPa [Volume 10, Issue 3, 2022, Pages 411-420]
-
Hard-sphere fluid
On the Effect of the Hard-sphere Term on the Statistical Associating Fluid Theory Equation of State [Volume 10, Issue 1, 2022, Pages 45-56]
-
HCT116 p53
Combined 3D-QSAR and Molecular Docking Analysis of Styrylquinoline Derivatives as Potent anti-cancer Agents [Volume 10, Issue 3, 2022, Pages 345-362]
-
Hexacyanoruthenate(II)
An Inhibitory Kinetic Method for the Methionine Determination [Volume 10, Issue 2, 2022, Pages 283-292]
-
Hydrogen bonding
Effect of Polarity on the Interaction Energies of some Organic Solvent (OS)-Water System and Formation of Donor-acceptor Complex: Quantum Mechanical MP4 Study [Volume 10, Issue 1, 2022, Pages 127-141]
-
Hydrolytic stability
Kinetic Analysis of Hydrolytic Decomposition of Rubrocurcumin Analogues [Volume 10, Issue 2, 2022, Pages 251-265]
-
Hydrothermal method
Structural, Morphological, and Optical Studies of ZnS-MoS2 Nanocomposite via Hydrothermal Route [Volume 10, Issue 2, 2022, Pages 293-300]
I
-
Impedance
A Study of Some Excess Thermodynamic Properties in Binary Mixtures of Non-Aqueous Solvents at Variable Temperatures [Volume 10, Issue 3, 2022, Pages 439-453]
-
Inhibition constant (Ki)
Modified D-Glucofuranoses as New Black Fungus Protease Inhibitors: Computational Screening, Docking, Dynamics, and QSAR Study [Volume 10, Issue 2, 2022, Pages 195-209]
-
Inhibitory effect
An Inhibitory Kinetic Method for the Methionine Determination [Volume 10, Issue 2, 2022, Pages 283-292]
-
Interfacial
Interfacial Synthesis of Polyaniline-(Ag-Au) Alloy Nanocomposite [Volume 10, Issue 2, 2022, Pages 273-281]
-
Interfacial Tension
Measuring Interfacial Tension Between Oil and Nano-Saline Solutions in the Presence of SiO2 or TiO2 at Low and Intermediate Pressures [Volume 10, Issue 2, 2022, Pages 163-171]
-
Intermolecular free length
A Study of Some Excess Thermodynamic Properties in Binary Mixtures of Non-Aqueous Solvents at Variable Temperatures [Volume 10, Issue 3, 2022, Pages 439-453]
-
Intermolecular Interactions
Excess Speed of Sound and Excess Molar Isentropic Compressibility in Binary Mixtures of Selected Amines in 2-Methoxy Ethanol at Various Temperatures [Volume 10, Issue 3, 2022, Pages 379-390]
-
Isotherms
Adsorption of the Methylene Blue Dye in Environmental Water Samples by Biochar Obtained from the Valorization of Argan Shells [Volume 10, Issue 3, 2022, Pages 301-313]
K
-
Kinetic
Thermodynamic, Kinetic, Batch Adsorption and Isotherm Models for the Adsorption of Nickel from an Artificial Solution Using Chloroxylon Swietenia Activated Carbon [Volume 10, Issue 3, 2022, Pages 315-324]
-
Kinetics
Quality Parameters, Empirical and Kinetic Models of Lycopene and Beta-carotene Bioformation in Tomatoes (Solanum lycopersicum) [Volume 10, Issue 1, 2022, Pages 151-162]
-
Kinetics
Adsorption of the Methylene Blue Dye in Environmental Water Samples by Biochar Obtained from the Valorization of Argan Shells [Volume 10, Issue 3, 2022, Pages 301-313]
L
-
Ligand-receptor interaction
Docking and 2D-Structure-activity Relationship and ADMET Studies of Acetylcholinesterase Inhibitors [Volume 10, Issue 1, 2022, Pages 31-44]
-
Ligand substitution reaction
An Inhibitory Kinetic Method for the Methionine Determination [Volume 10, Issue 2, 2022, Pages 283-292]
-
Light cycle oil desulfurization
Optimization of the Oxidative Desulfurization Process of Light Cycle Oil with NiMo/γ Al2O3 Catalyst [Volume 10, Issue 1, 2022, Pages 57-67]
-
Liquid-liquid equilibria
Liquid-liquid Equilibrium Data of Aqueous Mixtures of Butyric Acid with 2-Methylcyclohexanol at Different Temperatures and 102.1 kPa [Volume 10, Issue 3, 2022, Pages 411-420]
-
Loss tangent
Dielectric Properties of Ultra-Low Dielectric Constant PVA-Pentaerythritol/MnO2 Nanocomposite [Volume 10, Issue 3, 2022, Pages 325-331]
M
-
MATLAB
Effect of Temperature and Electrode Thickness on the Performance of Dye-Sensitized Solar Cells [Volume 10, Issue 1, 2022, Pages 23-30]
-
Memantine hydrochloride
Voltammetric and Spectroscopic Studies of Memantine Hydrochloride and its Transition Metal Complexes [Volume 10, Issue 1, 2022, Pages 13-21]
-
Membrane
Calculation of Structural Parameters and Diffusion Coefficient of Sodium Dodecyl Sulfate at Concentrations Lower and Higher Than the Critical Micelle Concentration in the Presence of Amyloid-Beta Peptide [Volume 10, Issue 4, 2022, Pages 571-579]
-
Methyl blue
Spherical α Fe2O3 Nanoparticles: Synthesis and Characterization and Its Photocatalytic Degradation of Methyl Orange and Methylene Blue [Volume 10, Issue 4, 2022, Pages 473-483]
-
Methyl Orange
Spherical α Fe2O3 Nanoparticles: Synthesis and Characterization and Its Photocatalytic Degradation of Methyl Orange and Methylene Blue [Volume 10, Issue 4, 2022, Pages 473-483]
-
MLR
Quantitative Structure-activity Relationship Studies and Nonlinear Optical Properties of 2-Phenylbenzofuran Derivatives: A Density Functional Theory Study [Volume 10, Issue 1, 2022, Pages 105-125]
-
MnO2 nanorod
Dielectric Properties of Ultra-Low Dielectric Constant PVA-Pentaerythritol/MnO2 Nanocomposite [Volume 10, Issue 3, 2022, Pages 325-331]
-
Mobility
Calculation of Structural Parameters and Diffusion Coefficient of Sodium Dodecyl Sulfate at Concentrations Lower and Higher Than the Critical Micelle Concentration in the Presence of Amyloid-Beta Peptide [Volume 10, Issue 4, 2022, Pages 571-579]
-
Molar volume
A Study of Some Excess Thermodynamic Properties in Binary Mixtures of Non-Aqueous Solvents at Variable Temperatures [Volume 10, Issue 3, 2022, Pages 439-453]
-
Molecular docking
Docking and 2D-Structure-activity Relationship and ADMET Studies of Acetylcholinesterase Inhibitors [Volume 10, Issue 1, 2022, Pages 31-44]
-
Molecular docking
Modified D-Glucofuranoses as New Black Fungus Protease Inhibitors: Computational Screening, Docking, Dynamics, and QSAR Study [Volume 10, Issue 2, 2022, Pages 195-209]
-
Molecular docking
Combined 3D-QSAR and Molecular Docking Analysis of Styrylquinoline Derivatives as Potent anti-cancer Agents [Volume 10, Issue 3, 2022, Pages 345-362]
-
Molecular docking
Modified Thymidine Derivatives as Potential Inhibitors of SARS-CoV: PASS, In Vitro Antimicrobial, Physicochemical and Molecular Docking Studies [Volume 10, Issue 3, 2022, Pages 391-409]
-
Molecular docking
In Silico Prediction of Novel (TRIM24) Bromodomain Inhibitors: A Combination of 3D-QSAR, Molecular Docking, ADMET Prediction, and Molecular Dynamics Simulation [Volume 10, Issue 4, 2022, Pages 519-535]
-
Molecular Dynamics
Modified D-Glucofuranoses as New Black Fungus Protease Inhibitors: Computational Screening, Docking, Dynamics, and QSAR Study [Volume 10, Issue 2, 2022, Pages 195-209]
-
Molecular Dynamics
In Silico Prediction of Novel (TRIM24) Bromodomain Inhibitors: A Combination of 3D-QSAR, Molecular Docking, ADMET Prediction, and Molecular Dynamics Simulation [Volume 10, Issue 4, 2022, Pages 519-535]
-
Molecular Modeling
Benzimidazole Derivatives in Identifying Novel Acetylcholinesterase Inhibitors: A Combination of 3D-QSAR, Docking and Molecular Dynamics Simulation [Volume 10, Issue 2, 2022, Pages 237-249]
-
Molecular Modeling
Study on the Molecular Interaction of Anthocyanin-rich Eggplant Extracts with Bovine α-Lactalbumin [Volume 10, Issue 4, 2022, Pages 485-494]
-
Monolayer capacity
The Modification of the BET Surface Area by Considering the Excluded Area of Adsorbed Molecules [Volume 10, Issue 2, 2022, Pages 173-177]
-
MoS2
Structural, Morphological, and Optical Studies of ZnS-MoS2 Nanocomposite via Hydrothermal Route [Volume 10, Issue 2, 2022, Pages 293-300]
-
MP4
Effect of Polarity on the Interaction Energies of some Organic Solvent (OS)-Water System and Formation of Donor-acceptor Complex: Quantum Mechanical MP4 Study [Volume 10, Issue 1, 2022, Pages 127-141]
-
Multivariate image analysis-QSAR (MIA-QSAR)
Docking and 2D-Structure-activity Relationship and ADMET Studies of Acetylcholinesterase Inhibitors [Volume 10, Issue 1, 2022, Pages 31-44]
N
-
Nanocomposites
Interfacial Synthesis of Polyaniline-(Ag-Au) Alloy Nanocomposite [Volume 10, Issue 2, 2022, Pages 273-281]
-
Nanopowder
Structural and Morphological Studies on Strontium Tin Phosphate SrSn(PO4)2 Nanopowder [Volume 10, Issue 2, 2022, Pages 267-271]
-
Nasunin
Study on the Molecular Interaction of Anthocyanin-rich Eggplant Extracts with Bovine α-Lactalbumin [Volume 10, Issue 4, 2022, Pages 485-494]
-
NBO
Quantitative Structure-activity Relationship Studies and Nonlinear Optical Properties of 2-Phenylbenzofuran Derivatives: A Density Functional Theory Study [Volume 10, Issue 1, 2022, Pages 105-125]
-
NBO
Effect of Polarity on the Interaction Energies of some Organic Solvent (OS)-Water System and Formation of Donor-acceptor Complex: Quantum Mechanical MP4 Study [Volume 10, Issue 1, 2022, Pages 127-141]
-
NBO and NCI
Theoretical Investigation on Inclusion Complex of (s)-2-Isopropyl-1-(o-nitrophenyl) Sulfonyl) Aziridine with β-Cyclodextrin [Volume 10, Issue 1, 2022, Pages 69-87]
-
Nickel(II) ions
Thermodynamic, Kinetic, Batch Adsorption and Isotherm Models for the Adsorption of Nickel from an Artificial Solution Using Chloroxylon Swietenia Activated Carbon [Volume 10, Issue 3, 2022, Pages 315-324]
-
NiMo/γ-Al2O3 catalyst
Optimization of the Oxidative Desulfurization Process of Light Cycle Oil with NiMo/γ Al2O3 Catalyst [Volume 10, Issue 1, 2022, Pages 57-67]
-
NLO
Quantitative Structure-activity Relationship Studies and Nonlinear Optical Properties of 2-Phenylbenzofuran Derivatives: A Density Functional Theory Study [Volume 10, Issue 1, 2022, Pages 105-125]
-
NMR
The Effects of Silicon Oxide on the Structure, Physical Chemistry Properties, and Bioactivity of Phosphate Glasses Containing Sodium, Strontium, and Titanium Oxides [Volume 10, Issue 1, 2022, Pages 1-12]
-
NMR
Experimental and Theoretical Spectroscopic Studies of the Electronic Structure of 2-Ethyl-2-phenylmalonamide [Volume 10, Issue 3, 2022, Pages 333-344]
-
NMR
An In Vivo Synergistic Research on the Assessment of the Phytocompound Capped Silver Nanoparticles from Raphanus sativus Leaf Extract and Curcuma longa Against UTI-Causing E.coli. [Volume 10, Issue 4, 2022, Pages 581-588]
-
NRTL model
Liquid-liquid Equilibrium Data of Aqueous Mixtures of Butyric Acid with 2-Methylcyclohexanol at Different Temperatures and 102.1 kPa [Volume 10, Issue 3, 2022, Pages 411-420]
-
NRTL model
Evaluation of the Thermal Properties of Ternary Mixtures of Fatty Acids for Green Thermal Energy Storage Application [Volume 10, Issue 4, 2022, Pages 461-471]
O
-
Organic solvent (OS)
Effect of Polarity on the Interaction Energies of some Organic Solvent (OS)-Water System and Formation of Donor-acceptor Complex: Quantum Mechanical MP4 Study [Volume 10, Issue 1, 2022, Pages 127-141]
-
Organic solvents (OS)
Physicochemical Properties and Structural Analysis of Some Organic Solvent (OS)-Water Systems: A Quantum Mechanical Study [Volume 10, Issue 4, 2022, Pages 559-570]
-
Othmer-Tobias
Liquid-liquid Equilibrium Data of Aqueous Mixtures of Butyric Acid with 2-Methylcyclohexanol at Different Temperatures and 102.1 kPa [Volume 10, Issue 3, 2022, Pages 411-420]
-
Oxidative desulfurization catalyst
Optimization of the Oxidative Desulfurization Process of Light Cycle Oil with NiMo/γ Al2O3 Catalyst [Volume 10, Issue 1, 2022, Pages 57-67]
P
-
Pearson HSAB principle
Computational Study of the Correlation of in-vitro Antiviral Activities Against SARS-CoV-2 with Different Theoretical Descriptors [Volume 10, Issue 3, 2022, Pages 429-438]
-
Perchlorate salt
Density, Refractive Index, and Electrical Conductivity of Ternary Mixtures Containing 1,3-Butanediol + Sulfolane (TMS) + Perchlorate Salts at Different Temperatures and Atmospheric Pressure [Volume 10, Issue 3, 2022, Pages 363-378]
-
Pharmaceutical preparations
An Inhibitory Kinetic Method for the Methionine Determination [Volume 10, Issue 2, 2022, Pages 283-292]
-
Phase change material
Evaluation of the Thermal Properties of Ternary Mixtures of Fatty Acids for Green Thermal Energy Storage Application [Volume 10, Issue 4, 2022, Pages 461-471]
-
Photo-degradation
Preparation of Schiff Bases Derived from Chitosan and Investigate their Photostability and Thermal Stability [Volume 10, Issue 4, 2022, Pages 549-557]
-
Photo-stability
Preparation of Schiff Bases Derived from Chitosan and Investigate their Photostability and Thermal Stability [Volume 10, Issue 4, 2022, Pages 549-557]
-
Physicochemical property
Physicochemical Properties and Structural Analysis of Some Organic Solvent (OS)-Water Systems: A Quantum Mechanical Study [Volume 10, Issue 4, 2022, Pages 559-570]
-
Polarization method
Synthesized of Novel Imidazole-derived Schiff Base as a Corrosion Inhibitor of Carbon Steel in Acidic Medium Supported by Electrochemical and DFT Studies [Volume 10, Issue 2, 2022, Pages 179-194]
-
Pollution
Activated Empty Palm Fruit Bunch for the Adsorption of Heavy Metal Ions: Kinetics and Thermodynamics [Volume 10, Issue 4, 2022, Pages 505-518]
-
Polyaniline
Interfacial Synthesis of Polyaniline-(Ag-Au) Alloy Nanocomposite [Volume 10, Issue 2, 2022, Pages 273-281]
-
Prothionamide
The Effects of the Ionic Field Strength of Be2+, Mg2+, and Ca2+ and a Static Electric Field (SEF) on the Interaction Between Prothionamide and B12P12 Nanocage: A DFT and TD-DFT Study [Volume 10, Issue 1, 2022, Pages 89-104]
-
PVA/PEG coating
Effect of PVA/PEG-coated Fe3O4 Nanoparticles on the Structure, Morphology and Magnetic Properties [Volume 10, Issue 4, 2022, Pages 537-547]
Q
-
QSAR
Quantitative Structure-activity Relationship Studies and Nonlinear Optical Properties of 2-Phenylbenzofuran Derivatives: A Density Functional Theory Study [Volume 10, Issue 1, 2022, Pages 105-125]
-
QSAR
Modified D-Glucofuranoses as New Black Fungus Protease Inhibitors: Computational Screening, Docking, Dynamics, and QSAR Study [Volume 10, Issue 2, 2022, Pages 195-209]
-
Quantum calculations
Modified Thymidine Derivatives as Potential Inhibitors of SARS-CoV: PASS, In Vitro Antimicrobial, Physicochemical and Molecular Docking Studies [Volume 10, Issue 3, 2022, Pages 391-409]
R
-
Radial distribution function
On the Effect of the Hard-sphere Term on the Statistical Associating Fluid Theory Equation of State [Volume 10, Issue 1, 2022, Pages 45-56]
-
Raman
The Effects of Silicon Oxide on the Structure, Physical Chemistry Properties, and Bioactivity of Phosphate Glasses Containing Sodium, Strontium, and Titanium Oxides [Volume 10, Issue 1, 2022, Pages 1-12]
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Raphanus sativus
An In Vivo Synergistic Research on the Assessment of the Phytocompound Capped Silver Nanoparticles from Raphanus sativus Leaf Extract and Curcuma longa Against UTI-Causing E.coli. [Volume 10, Issue 4, 2022, Pages 581-588]
-
Refractive indices
Density, Refractive Index, and Electrical Conductivity of Ternary Mixtures Containing 1,3-Butanediol + Sulfolane (TMS) + Perchlorate Salts at Different Temperatures and Atmospheric Pressure [Volume 10, Issue 3, 2022, Pages 363-378]
S
-
SARS-CoV-2
Computational Study of the Correlation of in-vitro Antiviral Activities Against SARS-CoV-2 with Different Theoretical Descriptors [Volume 10, Issue 3, 2022, Pages 429-438]
-
SARS-COV Mpro
Modified Thymidine Derivatives as Potential Inhibitors of SARS-CoV: PASS, In Vitro Antimicrobial, Physicochemical and Molecular Docking Studies [Volume 10, Issue 3, 2022, Pages 391-409]
-
Satureja hortensis L
Deep Eutectic Solvent as a Green Solvent for Fast Analysis of the Volatile Components of Satureja Hortensis L. [Volume 10, Issue 3, 2022, Pages 421-428]
-
Scanning electron microscopy (SEM)
Dielectric Properties of Ultra-Low Dielectric Constant PVA-Pentaerythritol/MnO2 Nanocomposite [Volume 10, Issue 3, 2022, Pages 325-331]
-
Schiff bases
Preparation of Schiff Bases Derived from Chitosan and Investigate their Photostability and Thermal Stability [Volume 10, Issue 4, 2022, Pages 549-557]
-
SEF
The Effects of the Ionic Field Strength of Be2+, Mg2+, and Ca2+ and a Static Electric Field (SEF) on the Interaction Between Prothionamide and B12P12 Nanocage: A DFT and TD-DFT Study [Volume 10, Issue 1, 2022, Pages 89-104]
-
SEM
Synthesized of Novel Imidazole-derived Schiff Base as a Corrosion Inhibitor of Carbon Steel in Acidic Medium Supported by Electrochemical and DFT Studies [Volume 10, Issue 2, 2022, Pages 179-194]
-
SEM Histopathology
An In Vivo Synergistic Research on the Assessment of the Phytocompound Capped Silver Nanoparticles from Raphanus sativus Leaf Extract and Curcuma longa Against UTI-Causing E.coli. [Volume 10, Issue 4, 2022, Pages 581-588]
-
Silver nanoparticles
An In Vivo Synergistic Research on the Assessment of the Phytocompound Capped Silver Nanoparticles from Raphanus sativus Leaf Extract and Curcuma longa Against UTI-Causing E.coli. [Volume 10, Issue 4, 2022, Pages 581-588]
-
SiO2 nanoparticles
Measuring Interfacial Tension Between Oil and Nano-Saline Solutions in the Presence of SiO2 or TiO2 at Low and Intermediate Pressures [Volume 10, Issue 2, 2022, Pages 163-171]
-
Solid-state reaction method
Structural and Morphological Studies on Strontium Tin Phosphate SrSn(PO4)2 Nanopowder [Volume 10, Issue 2, 2022, Pages 267-271]
-
Specific surface area
The Modification of the BET Surface Area by Considering the Excluded Area of Adsorbed Molecules [Volume 10, Issue 2, 2022, Pages 173-177]
-
Spectral characterization
Voltammetric and Spectroscopic Studies of Memantine Hydrochloride and its Transition Metal Complexes [Volume 10, Issue 1, 2022, Pages 13-21]
-
Speed of sound
Excess Speed of Sound and Excess Molar Isentropic Compressibility in Binary Mixtures of Selected Amines in 2-Methoxy Ethanol at Various Temperatures [Volume 10, Issue 3, 2022, Pages 379-390]
-
Spiroborate complex
Kinetic Analysis of Hydrolytic Decomposition of Rubrocurcumin Analogues [Volume 10, Issue 2, 2022, Pages 251-265]
-
Statistical Associating Fluid Theory (SAFT)
On the Effect of the Hard-sphere Term on the Statistical Associating Fluid Theory Equation of State [Volume 10, Issue 1, 2022, Pages 45-56]
-
Strontium tin phosphate
Structural and Morphological Studies on Strontium Tin Phosphate SrSn(PO4)2 Nanopowder [Volume 10, Issue 2, 2022, Pages 267-271]
-
Styrylquinoline
Combined 3D-QSAR and Molecular Docking Analysis of Styrylquinoline Derivatives as Potent anti-cancer Agents [Volume 10, Issue 3, 2022, Pages 345-362]
-
Sugar esters (SEs)
Modified D-Glucofuranoses as New Black Fungus Protease Inhibitors: Computational Screening, Docking, Dynamics, and QSAR Study [Volume 10, Issue 2, 2022, Pages 195-209]
-
Sulfolane
Density, Refractive Index, and Electrical Conductivity of Ternary Mixtures Containing 1,3-Butanediol + Sulfolane (TMS) + Perchlorate Salts at Different Temperatures and Atmospheric Pressure [Volume 10, Issue 3, 2022, Pages 363-378]
-
Superparamagnetic
Effect of PVA/PEG-coated Fe3O4 Nanoparticles on the Structure, Morphology and Magnetic Properties [Volume 10, Issue 4, 2022, Pages 537-547]
-
Surface area determination
The Modification of the BET Surface Area by Considering the Excluded Area of Adsorbed Molecules [Volume 10, Issue 2, 2022, Pages 173-177]
T
-
TEM
Interfacial Synthesis of Polyaniline-(Ag-Au) Alloy Nanocomposite [Volume 10, Issue 2, 2022, Pages 273-281]
-
Temperature
Effect of Temperature and Electrode Thickness on the Performance of Dye-Sensitized Solar Cells [Volume 10, Issue 1, 2022, Pages 23-30]
-
Ternary system
Evaluation of the Thermal Properties of Ternary Mixtures of Fatty Acids for Green Thermal Energy Storage Application [Volume 10, Issue 4, 2022, Pages 461-471]
-
The mechanism for the hydrolysis
Kinetic Analysis of Hydrolytic Decomposition of Rubrocurcumin Analogues [Volume 10, Issue 2, 2022, Pages 251-265]
-
Theoretical descriptors
Computational Study of the Correlation of in-vitro Antiviral Activities Against SARS-CoV-2 with Different Theoretical Descriptors [Volume 10, Issue 3, 2022, Pages 429-438]
-
Thermodynamic Modeling
On the Effect of the Hard-sphere Term on the Statistical Associating Fluid Theory Equation of State [Volume 10, Issue 1, 2022, Pages 45-56]
-
Thermogravimetric analysis
Interfacial Synthesis of Polyaniline-(Ag-Au) Alloy Nanocomposite [Volume 10, Issue 2, 2022, Pages 273-281]
-
Thymidine
Modified Thymidine Derivatives as Potential Inhibitors of SARS-CoV: PASS, In Vitro Antimicrobial, Physicochemical and Molecular Docking Studies [Volume 10, Issue 3, 2022, Pages 391-409]
-
TiO2 nanoparticles
Measuring Interfacial Tension Between Oil and Nano-Saline Solutions in the Presence of SiO2 or TiO2 at Low and Intermediate Pressures [Volume 10, Issue 2, 2022, Pages 163-171]
-
Topological Analysis
Density Functional Theory Study of the Reaction Behavior Histidine Modified Polyamidoamine Dendrimer as Nanocarrier for Delivery of Ectoine Drug [Volume 10, Issue 2, 2022, Pages 225-236]
-
Transition metal complexes
Voltammetric and Spectroscopic Studies of Memantine Hydrochloride and its Transition Metal Complexes [Volume 10, Issue 1, 2022, Pages 13-21]
-
Transport properties
Calculation of Structural Parameters and Diffusion Coefficient of Sodium Dodecyl Sulfate at Concentrations Lower and Higher Than the Critical Micelle Concentration in the Presence of Amyloid-Beta Peptide [Volume 10, Issue 4, 2022, Pages 571-579]
-
TRIM24 bromodomain
In Silico Prediction of Novel (TRIM24) Bromodomain Inhibitors: A Combination of 3D-QSAR, Molecular Docking, ADMET Prediction, and Molecular Dynamics Simulation [Volume 10, Issue 4, 2022, Pages 519-535]
V
-
Vibration spectra
Experimental and Theoretical Spectroscopic Studies of the Electronic Structure of 2-Ethyl-2-phenylmalonamide [Volume 10, Issue 3, 2022, Pages 333-344]
-
Viscosity
A Study of Some Excess Thermodynamic Properties in Binary Mixtures of Non-Aqueous Solvents at Variable Temperatures [Volume 10, Issue 3, 2022, Pages 439-453]
W
-
Waste management & disposal
Activated Empty Palm Fruit Bunch for the Adsorption of Heavy Metal Ions: Kinetics and Thermodynamics [Volume 10, Issue 4, 2022, Pages 505-518]
-
Water
Effect of Polarity on the Interaction Energies of some Organic Solvent (OS)-Water System and Formation of Donor-acceptor Complex: Quantum Mechanical MP4 Study [Volume 10, Issue 1, 2022, Pages 127-141]
-
Wettability
Measuring Interfacial Tension Between Oil and Nano-Saline Solutions in the Presence of SiO2 or TiO2 at Low and Intermediate Pressures [Volume 10, Issue 2, 2022, Pages 163-171]
X
-
X-ray diffraction (XRD)
Dielectric Properties of Ultra-Low Dielectric Constant PVA-Pentaerythritol/MnO2 Nanocomposite [Volume 10, Issue 3, 2022, Pages 325-331]
-
XRD
Interfacial Synthesis of Polyaniline-(Ag-Au) Alloy Nanocomposite [Volume 10, Issue 2, 2022, Pages 273-281]
-
XRD
Structural, Morphological, and Optical Studies of ZnS-MoS2 Nanocomposite via Hydrothermal Route [Volume 10, Issue 2, 2022, Pages 293-300]
-
XRD
XRD, EPR and FT-IR Studies of Zinc Aluminium Lithium Borate (ZALB) Glases Doped with Cu2+ Ions [Volume 10, Issue 4, 2022, Pages 455-460]
Z
-
ZnS
Structural, Morphological, and Optical Studies of ZnS-MoS2 Nanocomposite via Hydrothermal Route [Volume 10, Issue 2, 2022, Pages 293-300]
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