- Keyword Index

A

Ag Nanoparticles One-Pot Synthesis of Some Heterocyclic Organic Compounds by Magnetic Nanoparticles and its Application in Electrosynthesis of Silver Nanoparticles [Volume 12, Issue 38, 2022, Pages 26-15]
Alkoxymethyl morpholines Application of genetic algorithm-Multiple linear regression for prediction of dopamine receptor 4 (D4R) antagonists of alkoxymethyl morpholines [Volume 12, Issue 38, 2022, Pages 37-27]
Amido alkyl Naphthol Synthesis of amidoalkyl naphthols in solvent-free conditions using iron oxide, zinc oxide and copper oxide green nanocatalysts [Volume 12, Issue 40, 2022, Pages 16-1]
Artificial Neural Network Modeling and quantitative structure-activity study of some carboxylate derivatives as anticancer drugs using multivariate linear regression and artificial neural networks [Volume 12, Issue 38, 2022, Pages 68-55]
Artificial Neural Networks The application of multiple linear regression and artificial neural networks to study the quantitative structure-activity relationship of a group of chemokine derivatives [Volume 12, Issue 40, 2022, Pages 91-74]

B

Bilirubin Energetic and electronic properties of bilirubin photoisomerization products using density functional theory [Volume 12, Issue 39, 2022, Pages 50-39]
Biosensor effect of G-quadruplex on aromaticity of phenanthroline based ligands: mlecular dynamics simulation and density functional theory methods [Volume 12, Issue 39, 2022, Pages 38-29]

C

Caryophyllene and Spathulenol Chemical composition of the essential oil of Hymenocrater bituminosus by using spectroscopic manner GC and GC/MS [Volume 12, Issue 39, 2022, Pages 79-67]
Cope-type hydroamination Theoretical Study on the Kinetics and Thermodynamics of the Tandem Cope-Type Hydroamination and [2,3]- Meisenheimer Rearrangement Sequence [Volume 12, Issue 38, 2022, Pages 54-46]
Crossover temperature Theoretical Study on the Kinetics and Thermodynamics of the Tandem Cope-Type Hydroamination and [2,3]- Meisenheimer Rearrangement Sequence [Volume 12, Issue 38, 2022, Pages 54-46]
Cu (II) Dispersive Solid phase exteraction of trace Cu (II) in water samples using modified Nano Geraphene Oxide and determination by FAAS [Volume 12, Issue 39, 2022, Pages 15-1]

D

Density of state plot Energetic and electronic properties of bilirubin photoisomerization products using density functional theory [Volume 12, Issue 39, 2022, Pages 50-39]
DFT On the F2@C60 complex from the perspective of DFT Energy Partitioning Schemes [Volume 12, Issue 38, 2022, Pages 14-1]
Diazepam drug Study of exteraction of trace diazepam in water samples using Modified NanoTube carboxyl as sorbent [Volume 12, Issue 40, 2022, Pages 59-46]
Drug resistance Modeling and quantitative structure-activity study of some carboxylate derivatives as anticancer drugs using multivariate linear regression and artificial neural networks [Volume 12, Issue 38, 2022, Pages 68-55]

E

Eco-Friendly Synthesis of amidoalkyl naphthols in solvent-free conditions using iron oxide, zinc oxide and copper oxide green nanocatalysts [Volume 12, Issue 40, 2022, Pages 16-1]
Electrosynthesis One-Pot Synthesis of Some Heterocyclic Organic Compounds by Magnetic Nanoparticles and its Application in Electrosynthesis of Silver Nanoparticles [Volume 12, Issue 38, 2022, Pages 26-15]
Energy partitioning scheme On the F2@C60 complex from the perspective of DFT Energy Partitioning Schemes [Volume 12, Issue 38, 2022, Pages 14-1]
Essential oil Chemical composition of the essential oil of Hymenocrater bituminosus by using spectroscopic manner GC and GC/MS [Volume 12, Issue 39, 2022, Pages 79-67]
Essential oils Solvent-Free Microwave Extraction of essential oil of two artemisia ( A. spicigera و A. chamaemelifolia ) species from north of Iran [Volume 12, Issue 40, 2022, Pages 30-17]

F

F2@C60 On the F2@C60 complex from the perspective of DFT Energy Partitioning Schemes [Volume 12, Issue 38, 2022, Pages 14-1]
Flame atomic absorption spectrometry (FAAS) Dispersive Solid phase exteraction of trace Cu (II) in water samples using modified Nano Geraphene Oxide and determination by FAAS [Volume 12, Issue 39, 2022, Pages 15-1]
Functionalized Dispersive Solid phase exteraction of trace Cu (II) in water samples using modified Nano Geraphene Oxide and determination by FAAS [Volume 12, Issue 39, 2022, Pages 15-1]
Functionalized Multi Wall Carbon NanoTube carboxyl(MWCNT-COOH) Study of exteraction of trace diazepam in water samples using Modified NanoTube carboxyl as sorbent [Volume 12, Issue 40, 2022, Pages 59-46]

G

Gallium Phosphide Investigation of Phononic and thermal properties of Gallium Phosphide in two Zincblend and hexagonal phases [Volume 12, Issue 38, 2022, Pages 45-38]
GC/MS Solvent-Free Microwave Extraction of essential oil of two artemisia ( A. spicigera و A. chamaemelifolia ) species from north of Iran [Volume 12, Issue 40, 2022, Pages 30-17]
Green synthesis Synthesis of a new and recyclable Ce2Sn2O7 metal nanocatalyst for the three-component and efficient reaction (biginlli) of the 3,4-dihydropyrimidine (2H)one model [Volume 12, Issue 40, 2022, Pages 73-60]

H

Heterocycle organic composition One-Pot Synthesis of Some Heterocyclic Organic Compounds by Magnetic Nanoparticles and its Application in Electrosynthesis of Silver Nanoparticles [Volume 12, Issue 38, 2022, Pages 26-15]
HgTe Investigation of optical properties of HgTe using density functional theory [Volume 12, Issue 39, 2022, Pages 28-16]

I

Inhibition Constant Investigating the adsorption and antioxidant properties of Gallic acid on surface the B12N12 fullerene using quantum mechanical DFT and Molecular Docking [Volume 12, Issue 39, 2022, Pages 66-51]

K

Key words: Hymenocrater Bituminosos Chemical composition of the essential oil of Hymenocrater bituminosus by using spectroscopic manner GC and GC/MS [Volume 12, Issue 39, 2022, Pages 79-67]
Kinetics Theoretical Study on the Kinetics and Thermodynamics of the Tandem Cope-Type Hydroamination and [2,3]- Meisenheimer Rearrangement Sequence [Volume 12, Issue 38, 2022, Pages 54-46]

M

Magnetic nanoparticles One-Pot Synthesis of Some Heterocyclic Organic Compounds by Magnetic Nanoparticles and its Application in Electrosynthesis of Silver Nanoparticles [Volume 12, Issue 38, 2022, Pages 26-15]
Meisenheimer rearrangement Theoretical Study on the Kinetics and Thermodynamics of the Tandem Cope-Type Hydroamination and [2,3]- Meisenheimer Rearrangement Sequence [Volume 12, Issue 38, 2022, Pages 54-46]
MLR Application of genetic algorithm-Multiple linear regression for prediction of dopamine receptor 4 (D4R) antagonists of alkoxymethyl morpholines [Volume 12, Issue 38, 2022, Pages 37-27]
Molecular docking Investigating the adsorption and antioxidant properties of Gallic acid on surface the B12N12 fullerene using quantum mechanical DFT and Molecular Docking [Volume 12, Issue 39, 2022, Pages 66-51]
Molecular docking Molecular Docking and DFT Study On the Interaction Between Quercetin on surface B12N12 Fullerene [Volume 12, Issue 40, 2022, Pages 45-31]

N

Nano Geraphene Oxide Dispersive Solid phase exteraction of trace Cu (II) in water samples using modified Nano Geraphene Oxide and determination by FAAS [Volume 12, Issue 39, 2022, Pages 15-1]
Nanoparticle Synthesis of amidoalkyl naphthols in solvent-free conditions using iron oxide, zinc oxide and copper oxide green nanocatalysts [Volume 12, Issue 40, 2022, Pages 16-1]

P

Photoisomerization Energetic and electronic properties of bilirubin photoisomerization products using density functional theory [Volume 12, Issue 39, 2022, Pages 50-39]

Q

QSAR Application of genetic algorithm-Multiple linear regression for prediction of dopamine receptor 4 (D4R) antagonists of alkoxymethyl morpholines [Volume 12, Issue 38, 2022, Pages 37-27]
Quantitative structure-activity relationship Modeling and quantitative structure-activity study of some carboxylate derivatives as anticancer drugs using multivariate linear regression and artificial neural networks [Volume 12, Issue 38, 2022, Pages 68-55]
Quantitative structure-activity relationship The application of multiple linear regression and artificial neural networks to study the quantitative structure-activity relationship of a group of chemokine derivatives [Volume 12, Issue 40, 2022, Pages 91-74]
Quantum-Espresso Investigation of optical properties of HgTe using density functional theory [Volume 12, Issue 39, 2022, Pages 28-16]

R

Recycling Synthesis of a new and recyclable Ce2Sn2O7 metal nanocatalyst for the three-component and efficient reaction (biginlli) of the 3,4-dihydropyrimidine (2H)one model [Volume 12, Issue 40, 2022, Pages 73-60]

S

Solvent-free microwave extraction Solvent-Free Microwave Extraction of essential oil of two artemisia ( A. spicigera و A. chamaemelifolia ) species from north of Iran [Volume 12, Issue 40, 2022, Pages 30-17]
Synthesis Synthesis of amidoalkyl naphthols in solvent-free conditions using iron oxide, zinc oxide and copper oxide green nanocatalysts [Volume 12, Issue 40, 2022, Pages 16-1]

T

Thermal properties Investigation of Phononic and thermal properties of Gallium Phosphide in two Zincblend and hexagonal phases [Volume 12, Issue 38, 2022, Pages 45-38]
Thermodynamics Theoretical Study on the Kinetics and Thermodynamics of the Tandem Cope-Type Hydroamination and [2,3]- Meisenheimer Rearrangement Sequence [Volume 12, Issue 38, 2022, Pages 54-46]
Time-Dependent Density Functional Theory Energetic and electronic properties of bilirubin photoisomerization products using density functional theory [Volume 12, Issue 39, 2022, Pages 50-39]

U

UV-Vis spectrophotometery Study of exteraction of trace diazepam in water samples using Modified NanoTube carboxyl as sorbent [Volume 12, Issue 40, 2022, Pages 59-46]
UV-Vis Spectrum Energetic and electronic properties of bilirubin photoisomerization products using density functional theory [Volume 12, Issue 39, 2022, Pages 50-39]