abniki.milad
Dispersive solid-phase extraction for preconcentration of colored effluent in aqueous samples using magnetic carbon nanotubes modified with chitosan
[
Vol.9,
Issue
32
- WinterYear
1398]
abniki.milad
Preconcentration of trace amounts of lorazepam in aqueous samples by functionalizing graphene oxide with 2-aminopyridine
[
Vol.13,
Issue
42
- SummerYear
1402]
abniki.milad
Dispersive Solid phase exteraction of trace Cu (II) in water samples using modified Nano Geraphene Oxide and determination by FAAS
[
Vol.12,
Issue
39
- AutumnYear
1401]
abniki.milad
Study of exteraction of trace diazepam in water samples using Modified NanoTube carboxyl as sorbent
[
Vol.12,
Issue
40
- WinterYear
1401]
abniki.milad
Preconcentration of trace Co (II) in water samples using modified Multiwall nano tube carbon
[
Vol.11,
Issue
36
- AutumnYear
1400]
abniki.milad
Dispersive solid-phase extraction for preconcentration of Amlodipine in aqueous samples using Fe3O4@MWCNT- β cyclodextrin composite
[
Vol.11,
Issue
35
- SummerYear
1400]
abniki.milad
Removal of lead (II) using modified octadecyl silica nanomagnetic disks with dioctyl phthalate by atomic absorption spectroscopy
[
Vol.10,
Issue
33
- AutumnYear
1399]
afkhamy.vagehe
A Study of the adsorption of CO on cobalt nanostructures: Cubic and hexagonal crystalline phases
[
Vol.8,
Issue
26
- SummerYear
1397]
Ahmadi.Roya
Computational study of the effect of tin oxide nanoparticles on the thermodynamic properties of Mephedrone
[
Vol.9,
Issue
30
- SummerYear
1398]
Ahmadi.Roya
Investigating Levodopa Adsorption on the Surface of Graphene and Carbon Nanocone by Density Functional Theory
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Vol.9,
Issue
30
- SummerYear
1398]
Ahmadi.Sara
Theoretical study of the doping effects of iron and titanium atoms on the adsorption behavior of carbon nanosheet
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Vol.11,
Issue
37
- WinterYear
1400]
Alaei.Hamidreza
Si Adsorption on the borne phosphide honey-combe structure
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Vol.13,
Issue
41
- SpringYear
1402]
Alipour.Mojtaba
On the F2@C60 complex from the perspective of DFT Energy Partitioning Schemes
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Vol.12,
Issue
38
- SpringYear
1401]
Allameh.Sadegh
Structural study of a new copper complex using experimental method and quantum calculations and its application in the synthesis of pyranopyrimidines as catalyst
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Vol.11,
Issue
37
- WinterYear
1400]
Amarloo.Fatemeh
Synthesis of new magnetic FeNi3 / SiO2 / PPA magnetic nanocatalysts in tetrahydrobenzo [a] xanthene-11-ones reaction under solvent-free conditions
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Vol.9,
Issue
30
- SummerYear
1398]
Amarloo.Fatemeh
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
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Vol.12,
Issue
40
- WinterYear
1401]
Amiri.Peiman
Investigation of Phononic and thermal properties of Gallium Phosphide in two Zincblend and hexagonal phases
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Vol.12,
Issue
38
- SpringYear
1401]
Anaraki-Ardakani.Hossein
Investigation of the adsorption of copper (II) (soluble in water) on activated carbon produced from PET outflow bottles
[
Vol.8,
Issue
25
- SpringYear
1397]
Arab.Malihe
A theoretical study on the nature of formaldehyde adsroption on the C58BN heterofullerene using DFT
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Vol.9,
Issue
32
- WinterYear
1398]
B
Baei.Mohammad Taghi
Investigating the adsorption and antioxidant properties of Gallic acid on surface the B12N12 fullerene using quantum mechanical DFT and Molecular Docking
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Vol.12,
Issue
39
- AutumnYear
1401]
Baei.Mohammad Taghi
Energetic and electronic properties of bilirubin photoisomerization products using density functional theory
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Vol.12,
Issue
39
- AutumnYear
1401]
Baei.Mohammad Taghi
Molecular Docking and DFT Study On the Interaction Between Quercetin on surface B12N12 Fullerene
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Vol.12,
Issue
40
- WinterYear
1401]
bagheri.azar
Formation of Doxycycline-Palladium Complex: Determination of Thermodynamic Parameters Using the KINFIT Program
and determine of drug
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Vol.8,
Issue
26
- SummerYear
1397]
BakhBakhshian.Hossin
Use of spectroscopic manner GC and GC/MS for chemical composition of the essential oil pulicaria gnaphalodes (Vent) BOISS. From Iran
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Vol.8,
Issue
28
- WinterYear
1397]
balali.ebrahim
Study and comparison of Equilibrium vs. resonance in keto-enol tautomerization in some piroxicam derivatives
[
Vol.7,
Issue
22
- SummerYear
1396]
balali.ebrahim
The Study of absorption of drug anticancer Chlorambucil on Graphene: A DFT Study
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Vol.8,
Issue
25
- SpringYear
1397]
Bargi.Maryam
Investigation of intramolecular hydrogen bond in Anthranilic acid derivatives
[
Vol.7,
Issue
23
- AutumnYear
1396]
Bavafa.Sadeghali
Quantum chemical study of hydrogen bonded homodimers of NH2NW (W=O, S, Se)
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Vol.9,
Issue
31
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1398]
Bazobandi.Mohadese
effect of G-quadruplex on aromaticity of phenanthroline based ligands: mlecular dynamics simulation and density functional theory methods
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Vol.12,
Issue
39
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1401]
Beyramabadi.S. Ali
Investigating the effect of external electric field on the neurotransmitters acetylcholine, dopamine, GABA, glutamate and serotonin using density functional theory method
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Vol.13,
Issue
41
- SpringYear
1402]
Beyramabadi.S. Ali
DFT investigation of chitosan nanoparticle as hydroxyurea nanocarrier
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Vol.11,
Issue
37
- WinterYear
1400]
Beyramabadi.Safar Ali
Theoretical Study of Some Imidazo[1,2-a]Pyrimidines: Structural Optimization, Mechanism and Spectroscopy
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Vol.10,
Issue
34
- WinterYear
1399]
Beyramabadi.Safar Ali
Structural study of a new copper complex using experimental method and quantum calculations and its application in the synthesis of pyranopyrimidines as catalyst
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Vol.11,
Issue
37
- WinterYear
1400]
Bozorgmehr.Mohammad Reza
DFT investigation of chitosan nanoparticle as hydroxyurea nanocarrier
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Vol.11,
Issue
37
- WinterYear
1400]
Bozorgmehr.Mohammad Reza
Studying the π-π interaction between single-stranded oligonucleotides and single-walled carbon nanotubes by molecular dynamics simulation and density functional theory
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Vol.13,
Issue
42
- SummerYear
1402]
Bozorgmehr.Mohammad Reza
Investigating the effect of external electric field on the neurotransmitters acetylcholine, dopamine, GABA, glutamate and serotonin using density functional theory method
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Vol.13,
Issue
41
- SpringYear
1402]
Bozorgmehr.Mohammad Reza
effect of G-quadruplex on aromaticity of phenanthroline based ligands: mlecular dynamics simulation and density functional theory methods
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Vol.12,
Issue
39
- AutumnYear
1401]
Chahkandi.Behzad
Conformational analysis of For-L-Ser-L-Ala-NH2 protected dipeptide using quantum calculations: A DFT study
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Vol.9,
Issue
31
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1398]
Chahkandi.Behzad
Theoretical investigation of tautomerisation of 3-Amino-1H-1,2,4-Triazol-5(4H)-One by using quantum calculations by DFT method.
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Vol.8,
Issue
28
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1397]
Chahkandi.Behzad
Quantitative Structure-Property Relationship Study for Prediction of the Solvent Polarity Using Quantum Mechanics Descriptors and Support Vector Machine
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Vol.9,
Issue
29
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1398]
Chahkandi.Behzad
Theoretical investigation of Curtius rearrangement of oxalyl di azide molecule using quantum calculations in gas phase and solution
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Vol.11,
Issue
35
- SummerYear
1400]
Chahkandi.Behzad
Theoretical investigation of β-turn structures of serine-alanine protected dipeptide using quantum calculations
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Vol.11,
Issue
36
- AutumnYear
1400]
Chahkandi.Behzad
Theoretical study on the kinetics and mechanism of the atmospheric oxidation of acenaphthylene initiated by hydroxyl radical. Hydrogen Abstraction pathway
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Vol.10,
Issue
33
- AutumnYear
1399]
Chahkandi.Behzad
Modeling and quantitative structure-activity study of some carboxylate derivatives as anticancer drugs using multivariate linear regression and artificial neural networks
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Vol.12,
Issue
38
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1401]
darugar.vahidreza
A Study of the adsorption of CO on cobalt nanostructures: Cubic and hexagonal crystalline phases
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Vol.8,
Issue
26
- SummerYear
1397]
darugar.vahidreza
Investigation of the IntraMolecular Hydrogen Bonding in Halo, Methoxy, and Cyano-Malonealdehyde Derivatives
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Vol.9,
Issue
31
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1398]
Darugar.Vahidreza
Theoretical and experimental tautomerism study of para-Trifluorobenzoylacetone halogen derivatives using DFT and vibrational spectroscopy
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Vol.9,
Issue
29
- SpringYear
1398]
Darugar.Vahidreza
Tautomerization and Intramolecular Hydrogen bond Strength of para Chlorine-Benzoylacetone by Quantum Computation and Spectrometry Results
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Vol.7,
Issue
22
- SummerYear
1396]
Davoodnia.Abolghasem
Theoretical Study of Some Imidazo[1,2-a]Pyrimidines: Structural Optimization, Mechanism and Spectroscopy
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Vol.10,
Issue
34
- WinterYear
1399]
Dolati.Fatemeh
A Study of the adsorption of CO on cobalt nanostructures: Cubic and hexagonal crystalline phases
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Vol.8,
Issue
26
- SummerYear
1397]
Dolati.zohre
A Study of the adsorption of CO on cobalt nanostructures: Cubic and hexagonal crystalline phases
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Vol.8,
Issue
26
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1397]
E
Ebrahimi.Mahmood
Study of molecular and electronic structure of a new proton transfer compound with 2,6–pydc and py–3–cm: Synthesis and DFT calculations
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Vol.7,
Issue
23
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1396]
Ebrahimi.Mahmoud
Modeling and quantitative structure-activity study of some carboxylate derivatives as anticancer drugs using multivariate linear regression and artificial neural networks
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Vol.12,
Issue
38
- SpringYear
1401]
Eshghi.Hossein
Tautomerization and Intramolecular Hydrogen bond Strength of para Chlorine-Benzoylacetone by Quantum Computation and Spectrometry Results
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Vol.7,
Issue
22
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1396]
Esmaeili.Ali
Investigation of Jahn-Teller Effect in Distortion of OX2 (X=Cl. Br. I) Molecular System
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Vol.9,
Issue
30
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1398]
F
faridshaygan.fahimeh
Non-destructive spectroscopic methods in the identification and quantitative measurement of various mycotoxins in pistachios
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Vol.11,
Issue
35
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1400]
Fazaeli.Reza
Investigation of Jahn-Teller Effect in Distortion of OX2 (X=Cl. Br. I) Molecular System
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Vol.9,
Issue
30
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1398]
Feizyzadeh.Babak
Synthesis of amidoalkyl naphthols in solvent-free conditions using iron oxide, zinc oxide and copper oxide green nanocatalysts
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Vol.12,
Issue
40
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1401]
G
Ghaffari Jajin.Haniye
Application of genetic algorithm-Multiple linear regression for prediction of dopamine receptor 4 (D4R) antagonists of alkoxymethyl morpholines
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Vol.12,
Issue
38
- SpringYear
1401]
Ghalishourani.Farzanehsadat
Calculation of radiative transition parameters for the band system of B^3 ∏_g-A^3 ∑_u^+ of N_2 molecule and 〖A^2∏〗_u-X^2 ∑_g^+ , B^2 ∑_u^+- X^2 ∑_g^+ , and B^3 ∏_g-A^3 ∑_u^+ systems of N_2^+ molecular ion
using empirical potential energy functions
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Vol.8,
Issue
26
- SummerYear
1397]
Ghorbani.Seyed Hosein
Theoretical Study on the Kinetics and Thermodynamics of the Tandem Cope-Type Hydroamination and [2,3]- Meisenheimer Rearrangement Sequence
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Vol.12,
Issue
38
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1401]
H
hadigheh rezvan.vahideh
study of dithioglyoxal conformations and how it is formed from 1, 2-ditate by DFT method
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Vol.13,
Issue
41
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1402]
Hosseini.Seyed Javad
A tautomerism in 2-amino-7H-purine-6-thiol: Theoretical study using implicit/explicit salvation models
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Vol.7,
Issue
21
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1396]
Hosseini.Seyed Javad
Chemical composition essential oil obtained from Fruit and stem of Drema ammoniacum D. Don. By spectroscopic manner GC and GC-MS
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Vol.8,
Issue
25
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1397]
Hosseiny.Malihesadat
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
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Vol.12,
Issue
40
- WinterYear
1401]
I
Izadi.zienab
Calculation of optical properties of Na2S in different phases
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Vol.13,
Issue
41
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1402]
Izadi.Zinab
Investigation of optical properties of HgTe using density functional theory
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Vol.12,
Issue
39
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1401]
J
Jalali Sarvestani.Mohammad Reza
A Computational Study on Tetranitrocarbazole Interaction with Boron Nitride Nanocage (B12N12)
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Vol.9,
Issue
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1398]
Jalali Sarvestani.Mohammad Reza
Quetiapine Adsorption on the Surface of Fullerene (C20): A Thermodynamic Study
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Vol.8,
Issue
28
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1397]
Jalali Sarvestani.Mohammad Reza
Investigating Levodopa Adsorption on the Surface of Graphene and Carbon Nanocone by Density Functional Theory
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Vol.9,
Issue
30
- SummerYear
1398]
jamehbozorgi.saeed
The production of activated carbon from polyethyleneterephthalate
(PET ) bottle waste and its use to absorbtion iron (III) from water
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Vol.13,
Issue
41
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1402]
Jonidei.Shima
A Theoretical Study on Three Tautomeric Forms of Lenalidomide with Density Functional Theory
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Vol.8,
Issue
28
- WinterYear
1397]
Joorabloo.Mahnaz
Si Adsorption on the borne phosphide honey-combe structure
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Vol.13,
Issue
41
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1402]
K
Karami Osboo.Ruhollah
Non-destructive spectroscopic methods in the identification and quantitative measurement of various mycotoxins in pistachios
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Vol.11,
Issue
35
- SummerYear
1400]
Karami Osboo.Ruhollah
Review on mycotoxins determination by infrared spectroscopy and chemometrics in Food stuff
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Vol.9,
Issue
32
- WinterYear
1398]
kazemi babahydari.ali
Simulation of the interaction of the enzyme Fumarate reductase with Nizatidine and comparison with the inhibitory effect some Yarrow compounds of the plant to enhance the effects of Metronidazole on Helicobacter pylori in Insilico
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Vol.8,
Issue
28
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1397]
KHadem lahiji.Fatemeh
Review of the Mechanism of Acetyll amine N-Oxide Catalyzed by Carbon Gold (I) from a DFT Perspective
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Vol.10,
Issue
33
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1399]
khashi.maryam
Theoretical Study of Some Imidazo[1,2-a]Pyrimidines: Structural Optimization, Mechanism and Spectroscopy
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Vol.10,
Issue
34
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1399]
Khashi.Maryam
Theoretical Study of Some Imidazo[1,2-a]Pyrimidines: Structural Optimization, Mechanism and Spectroscopy
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Vol.10,
Issue
34
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1399]
Khojandi.Mahya
investigation of NMR and NQR tensors in the medicinal analogues of Methylphenidate
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Vol.10,
Issue
34
- WinterYear
1399]
Khojandi.Mahya
The comparision of NQR-NMR tensors and chemical reactivity of Mirtazapine and Normirtazapine analogues using quantum mechanics methods
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Vol.7,
Issue
22
- SummerYear
1396]
Koutchakzadeh.Ghazaleh
A Review of the Jahn-Teller Effects (Jahn -Teller, Renner-Teller, and Pseudo Jahn -Teller): The main origin of instability and symmetry breaking of molecular systems
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Vol.8,
Issue
25
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1397]
L
Liaghati.Mojdeh
The production of activated carbon from polyethyleneterephthalate
(PET ) bottle waste and its use to absorbtion iron (III) from water
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Vol.13,
Issue
41
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1402]
M
Madady.Nosrat
QSAR Study of New Biphenylic Derivatives as CB2 Receptor Ligands by Quantum Chemical Descriptors
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Vol.7,
Issue
22
- SummerYear
1396]
Maham.Mehdi
Camputational methods and quantitative structure–property relationship study for prediction of melting point of carbocyclic nitroaromatic compounds using chemical and quantum mechanics descriptors: combining DFT and QSPR calculations
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Vol.6,
Issue
19
- AutumnYear
1395]
Mahmoudi.Ali
effect of G-quadruplex on aromaticity of phenanthroline based ligands: mlecular dynamics simulation and density functional theory methods
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Vol.12,
Issue
39
- AutumnYear
1401]
Masoomi Aladezgeh.Samira
Application of genetic algorithm-Multiple linear regression for prediction of dopamine receptor 4 (D4R) antagonists of alkoxymethyl morpholines
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Vol.12,
Issue
38
- SpringYear
1401]
Meisami.Mohammad Reza
The electronic and molecular structures of some new Cu(II) complexes with tripodal amine ligands: DFT studies
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Vol.9,
Issue
29
- SpringYear
1398]
Miralinaghi.Mahsa Sadate
Calculation of radiative transition parameters for the band system of B^3 ∏_g-A^3 ∑_u^+ of N_2 molecule and 〖A^2∏〗_u-X^2 ∑_g^+ , B^2 ∑_u^+- X^2 ∑_g^+ , and B^3 ∏_g-A^3 ∑_u^+ systems of N_2^+ molecular ion
using empirical potential energy functions
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Vol.8,
Issue
26
- SummerYear
1397]
moghimi.ali
Dispersive Solid phase exteraction of trace Cu (II) in water samples using modified Nano Geraphene Oxide and determination by FAAS
[
Vol.12,
Issue
39
- AutumnYear
1401]
moghimi.ali
Study of exteraction of trace diazepam in water samples using Modified NanoTube carboxyl as sorbent
[
Vol.12,
Issue
40
- WinterYear
1401]
moghimi.ali
Preconcentration of trace amounts of lorazepam in aqueous samples by functionalizing graphene oxide with 2-aminopyridine
[
Vol.13,
Issue
42
- SummerYear
1402]
moghimi.ali
Preconcentration of trace Co (II) in water samples using modified Multiwall nano tube carbon
[
Vol.11,
Issue
36
- AutumnYear
1400]
moghimi.ali
Dispersive solid-phase extraction for preconcentration of Amlodipine in aqueous samples using Fe3O4@MWCNT- β cyclodextrin composite
[
Vol.11,
Issue
35
- SummerYear
1400]
moghimi.ali
Removal of lead (II) using modified octadecyl silica nanomagnetic disks with dioctyl phthalate by atomic absorption spectroscopy
[
Vol.10,
Issue
33
- AutumnYear
1399]
moghimi.ali
Dispersive solid-phase extraction for preconcentration of colored effluent in aqueous samples using magnetic carbon nanotubes modified with chitosan
[
Vol.9,
Issue
32
- WinterYear
1398]
moghimi.ali
Solid phase exteraction of trace Cu(II) in Islamshar waste water samples using modified Multiwall nano tube carbon
[
Vol.9,
Issue
29
- SpringYear
1398]
moghimi.ali
Preconcentration of Amlodipine using Fe3O4@MWCNT- chitosan compositeand determinated
by UV-Visb in biologycal samples
[
Vol.9,
Issue
30
- SummerYear
1398]
moghimi.ali
Solid Phase Extraction of Fluoxetine in water Samples by Carbon Nanotubes modified and its determination with Ultraviolet-Visible Spectrometry in Biological Samples
[
Vol.8,
Issue
28
- WinterYear
1397]
moghimi.ali
Extraction of drugs in water Samples by Carbon Nanotubes modified and Measurement with Ultraviolet-Visible Spectrometry
[
Vol.8,
Issue
26
- SummerYear
1397]
moghimi.ali
Removal trace CrO42- using funcationalization nano magnetic active Rice bran by Chitosan and determination using UV- Vis spectrometry
[
Vol.7,
Issue
23
- AutumnYear
1396]
moghimi.ali
Investigation of the adsorption of copper (II) (soluble in water) on activated carbon produced from PET outflow bottles
[
Vol.8,
Issue
25
- SpringYear
1397]
Mohaddesi.Alireza
QSAR Study of New Biphenylic Derivatives as CB2 Receptor Ligands by Quantum Chemical Descriptors
[
Vol.7,
Issue
22
- SummerYear
1396]
Mohammad Ebrahimzadeh Sepasgozar.Samaneh
Synthesis of amidoalkyl naphthols in solvent-free conditions using iron oxide, zinc oxide and copper oxide green nanocatalysts
[
Vol.12,
Issue
40
- WinterYear
1401]
Mohammadhosseini.Majid
Modeling and quantitative structure-property relationship (QSPR) study to predict the acidic constants of some chemical compounds using multiple linear regression and support vector machine
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Vol.9,
Issue
32
- WinterYear
1398]
Mohammadhosseini.Majid
The application of multiple linear regression and artificial neural networks to study the quantitative structure-activity relationship of a group of chemokine derivatives
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Vol.12,
Issue
40
- WinterYear
1401]
Mohammadi.Najmeh
QSAR Study of New Biphenylic Derivatives as CB2 Receptor Ligands by Quantum Chemical Descriptors
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Vol.7,
Issue
22
- SummerYear
1396]
Mohammadinasab.E.
Investigation of Jahn-Teller Effect in Distortion of OX2 (X=Cl. Br. I) Molecular System
[
Vol.9,
Issue
30
- SummerYear
1398]
Mohseni.sharareh
Synthesis of amidoalkyl naphthols in solvent-free conditions using iron oxide, zinc oxide and copper oxide green nanocatalysts
[
Vol.12,
Issue
40
- WinterYear
1401]
mokhavat.shiva
Investigation of Phononic and thermal properties of Gallium Phosphide in two Zincblend and hexagonal phases
[
Vol.12,
Issue
38
- SpringYear
1401]
Morsali.Ali
DFT investigation of chitosan nanoparticle as hydroxyurea nanocarrier
[
Vol.11,
Issue
37
- WinterYear
1400]
Morsali.Ali
Synthesis of amidoalkyl naphthols in solvent-free conditions using iron oxide, zinc oxide and copper oxide green nanocatalysts
[
Vol.12,
Issue
40
- WinterYear
1401]
Morsali.Ali
effect of G-quadruplex on aromaticity of phenanthroline based ligands: mlecular dynamics simulation and density functional theory methods
[
Vol.12,
Issue
39
- AutumnYear
1401]
Morsali.Ali
Structural study of a new copper complex using experimental method and quantum calculations and its application in the synthesis of pyranopyrimidines as catalyst
[
Vol.11,
Issue
37
- WinterYear
1400]
Morsali.Ali
Studying the π-π interaction between single-stranded oligonucleotides and single-walled carbon nanotubes by molecular dynamics simulation and density functional theory
[
Vol.13,
Issue
42
- SummerYear
1402]
mosalai.heidar
Preconcentration of Amlodipine using Fe3O4@MWCNT- chitosan compositeand determinated
by UV-Visb in biologycal samples
[
Vol.9,
Issue
30
- SummerYear
1398]
mosalai.heidar
Solid phase exteraction of trace Cu(II) in Islamshar waste water samples using modified Multiwall nano tube carbon
[
Vol.9,
Issue
29
- SpringYear
1398]
mosalai.heidar
Removal of lead (II) using modified octadecyl silica nanomagnetic disks with dioctyl phthalate by atomic absorption spectroscopy
[
Vol.10,
Issue
33
- AutumnYear
1399]
Motavalizadehkakhky.Alireza
Synthesis of new magnetic FeNi3 / SiO2 / PPA magnetic nanocatalysts in tetrahydrobenzo [a] xanthene-11-ones reaction under solvent-free conditions
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Vol.9,
Issue
30
- SummerYear
1398]
Motavalizadehkakhky.Alireza
Synthesis 3a, 4-dihydronaphtho [2, 3-c] furan-1(3H)-one in the presence of CO2 and NiCo2O4 Nano catalyst
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Vol.13,
Issue
42
- SummerYear
1402]
Motavalizadehkakhky.Alireza
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
[
Vol.12,
Issue
40
- WinterYear
1401]
Mozafari.Majid
A theoretical study on the nature of formaldehyde adsroption on the C58BN heterofullerene using DFT
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Vol.9,
Issue
32
- WinterYear
1398]
Mozafari.Majid
Application of spectroscopic methods for structural analysis of monoclinic bismuth vanadate nanoparticles (BiVO4) with different morphologies in the degradation of Rhodamine B dye
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Vol.7,
Issue
23
- AutumnYear
1396]
Mppsavi.Syed Hamed
Application of multivariate linear regression and artificial neural networks to predict the antimicrobial activity of some anilide derivatives by quantitative structure-activity relationship (QSAR) method
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Vol.11,
Issue
35
- SummerYear
1400]
N
Nakhaei Pour.Ali
A Study of the adsorption of CO on cobalt nanostructures: Cubic and hexagonal crystalline phases
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Vol.8,
Issue
26
- SummerYear
1397]
naseri.samira
The DFT studies on molecular configurations of Azacitidine
[
Vol.9,
Issue
30
- SummerYear
1398]
niazmand.omid
Application of spectroscopic methods for structural analysis of monoclinic bismuth vanadate nanoparticles (BiVO4) with different morphologies in the degradation of Rhodamine B dye
[
Vol.7,
Issue
23
- AutumnYear
1396]
nikkhah.afsaneh
Simulation of the interaction of the enzyme Fumarate reductase with Nizatidine and comparison with the inhibitory effect some Yarrow compounds of the plant to enhance the effects of Metronidazole on Helicobacter pylori in Insilico
[
Vol.8,
Issue
28
- WinterYear
1397]
nowroozi.alireza
Theoretical study of 2-selenoformyl-3-thioxo-propionaldehyde (STP) in the exited states
[
Vol.9,
Issue
29
- SpringYear
1398]
nowroozi.alireza
Quantum chemical study of hydrogen bonded homodimers of NH2NW (W=O, S, Se)
[
Vol.9,
Issue
31
- AutumnYear
1398]
O
Omidinia.Raheleh
Structural study of a new copper complex using experimental method and quantum calculations and its application in the synthesis of pyranopyrimidines as catalyst
[
Vol.11,
Issue
37
- WinterYear
1400]
Otovat.Fahime
Studying the π-π interaction between single-stranded oligonucleotides and single-walled carbon nanotubes by molecular dynamics simulation and density functional theory
[
Vol.13,
Issue
42
- SummerYear
1402]
P
pashazanosi.mohammadbagher
Identification and Comparison of the Extractives Chemical Compounds in Leaves of Planted Eldar Pine and Plane Tree by GC-MS Methods
[
Vol.10,
Issue
34
- WinterYear
1399]
pashazanosi.mohammadbagher
Solvent-Free Microwave Extraction of Essential oil of Artemisia annua
[
Vol.11,
Issue
36
- AutumnYear
1400]
pashazanosi.mohammadbagher
Solvent-Free Microwave Extraction of essential oil of two artemisia
( A. spicigera و A. chamaemelifolia ) species from north of Iran
[
Vol.12,
Issue
40
- WinterYear
1401]
Pordel.Mehdi
Structural study of a new copper complex using experimental method and quantum calculations and its application in the synthesis of pyranopyrimidines as catalyst
[
Vol.11,
Issue
37
- WinterYear
1400]
Pourali.Parastoo
Application of multivariate linear regression and artificial neural networks to predict the antimicrobial activity of some anilide derivatives by quantitative structure-activity relationship (QSAR) method
[
Vol.11,
Issue
35
- SummerYear
1400]
Pourbasheer.Eslam
Application of genetic algorithm-Multiple linear regression for prediction of dopamine receptor 4 (D4R) antagonists of alkoxymethyl morpholines
[
Vol.12,
Issue
38
- SpringYear
1401]
R
Raanaei.Hossein
Theoretical study of the doping effects of iron and titanium atoms on the adsorption behavior of carbon nanosheet
[
Vol.11,
Issue
37
- WinterYear
1400]
rafat.ramin
Theoretical study of 2-selenoformyl-3-thioxo-propionaldehyde (STP) in the exited states
[
Vol.9,
Issue
29
- SpringYear
1398]
Rahmani.Zoha
Theoretical investigations on the interactions of some drug fragments with guanine and adenine nucleic acid: DFT method, AIM analysis and NBO calculations
[
Vol.7,
Issue
23
- AutumnYear
1396]
S
Saberi.Shima
Synthesis 3a, 4-dihydronaphtho [2, 3-c] furan-1(3H)-one in the presence of CO2 and NiCo2O4 Nano catalyst
[
Vol.13,
Issue
42
- SummerYear
1402]
Sabzalivand.Soha
DFT-based study on Melphalan absorption on defective graphene-doped Si, Al and p
[
Vol.8,
Issue
26
- SummerYear
1397]
sadeghi googheri.motahare
Effects of pivalate ligand substitutions on the electronic properties of chromium-wheels host complexes; A molecular modelling study.
[
Vol.10,
Issue
33
- AutumnYear
1399]
sadeghpour.mahdieh
The use of DFT computational method to study the effect of physical factors on the pH range of color change of Azo indicator: Methyl red and Methyl Orange
[
Vol.11,
Issue
35
- SummerYear
1400]
Sahebalzamani.Hajar
Investigation the conformational stability2-methyl-pyrimidin-4-ol using Quantum chemical
[
Vol.9,
Issue
29
- SpringYear
1398]
Salehi.Hamdollah
Calculation of optical properties of Na2S in different phases
[
Vol.13,
Issue
41
- SpringYear
1402]
Salehi.Hamdollah
Investigation of optical properties of HgTe using density functional theory
[
Vol.12,
Issue
39
- AutumnYear
1401]
Salehi.Hamdollah
Investigation of Phononic and thermal properties of Gallium Phosphide in two Zincblend and hexagonal phases
[
Vol.12,
Issue
38
- SpringYear
1401]
Salehi.Hamdollah
An investigation of bulk module , Pressure transition and electronic properties of Calcium Carbonate using pseudopotential method
[
Vol.11,
Issue
36
- AutumnYear
1400]
salmani.farhad
Chemical composition essential oil obtained from Fruit and stem of Drema ammoniacum D. Don. By spectroscopic manner GC and GC-MS
[
Vol.8,
Issue
25
- SpringYear
1397]
Sanei.Mitra
Theoretical Study on the Kinetics and Thermodynamics of the Tandem Cope-Type Hydroamination and [2,3]- Meisenheimer Rearrangement Sequence
[
Vol.12,
Issue
38
- SpringYear
1401]
Seif.Ahmad
Theoretical Study on the Kinetics and Thermodynamics of the Tandem Cope-Type Hydroamination and [2,3]- Meisenheimer Rearrangement Sequence
[
Vol.12,
Issue
38
- SpringYear
1401]
shabani.Mohsen
Calculation of radiative transition parameters for the band system of B^3 ∏_g-A^3 ∑_u^+ of N_2 molecule and 〖A^2∏〗_u-X^2 ∑_g^+ , B^2 ∑_u^+- X^2 ∑_g^+ , and B^3 ∏_g-A^3 ∑_u^+ systems of N_2^+ molecular ion
using empirical potential energy functions
[
Vol.8,
Issue
26
- SummerYear
1397]
shahvelayati.ashrafosadat
Computational study of the effect of tin oxide nanoparticles on the thermodynamic properties of Mephedrone
[
Vol.9,
Issue
30
- SummerYear
1398]
Shams.Fatemeh
Quantitative structure–activity relationship study for predicting activity of some medicine compounds by firefly algorithm
[
Vol.8,
Issue
26
- SummerYear
1397]
Shanbedi,.amin
An investigation of bulk module , Pressure transition and electronic properties of Calcium Carbonate using pseudopotential method
[
Vol.11,
Issue
36
- AutumnYear
1400]
Sheshmani.Shabnam
Computational study of the effect of tin oxide nanoparticles on the thermodynamic properties of Mephedrone
[
Vol.9,
Issue
30
- SummerYear
1398]
Shojaee.Mohamd hoseein
Review on mycotoxins determination by infrared spectroscopy and chemometrics in Food stuff
[
Vol.9,
Issue
32
- WinterYear
1398]
Shojai.Mostafa
Dispersive solid-phase extraction for preconcentration of Amlodipine in aqueous samples using Fe3O4@MWCNT- β cyclodextrin composite
[
Vol.11,
Issue
35
- SummerYear
1400]
Shojai.Mostafa
Study of exteraction of trace diazepam in water samples using Modified NanoTube carboxyl as sorbent
[
Vol.12,
Issue
40
- WinterYear
1401]
siminghad.masoomeh
Computational study of the effect of tin oxide nanoparticles on the thermodynamic properties of Mephedrone
[
Vol.9,
Issue
30
- SummerYear
1398]
T
Tahan.Arezoo
The comparision of NQR-NMR tensors and chemical reactivity of Mirtazapine and Normirtazapine analogues using quantum mechanics methods
[
Vol.7,
Issue
22
- SummerYear
1396]
Taheri.Abbass
Prediction of Retention Index of Ammoides Atlantica Compounds Using Quantitative Structure-Retention Relationship Study (QSRR)
[
Vol.10,
Issue
34
- WinterYear
1399]
Taheri.Abbass
Modeling and quantitative structure-property relationship (QSPR) study to predict the acidic constants of some chemical compounds using multiple linear regression and support vector machine
[
Vol.9,
Issue
32
- WinterYear
1398]
Taheri.Maryam
Energetic and electronic properties of bilirubin photoisomerization products using density functional theory
[
Vol.12,
Issue
39
- AutumnYear
1401]
Taheryan.Roghaye
Theoretical investigation of Curtius rearrangement of oxalyl di azide molecule using quantum calculations in gas phase and solution
[
Vol.11,
Issue
35
- SummerYear
1400]
talebi.maryam
Theoretical study on the kinetics and mechanism of the atmospheric oxidation of acenaphthylene initiated by hydroxyl radical. Hydrogen Abstraction pathway
[
Vol.10,
Issue
33
- AutumnYear
1399]
tavakoli hafshejani.Khadijah
Investigating the adsorption and antioxidant properties of Gallic acid on surface the B12N12 fullerene using quantum mechanical DFT and Molecular Docking
[
Vol.12,
Issue
39
- AutumnYear
1401]
tavakoli hafshejani.Khadijah
The Study of Yarrow's Effect on Helicobacter Pylori with Ducting Molecular Simulation
[
Vol.9,
Issue
31
- AutumnYear
1398]
tavakoli hafshejani.Khadijah
Simulation of the interaction of the enzyme Fumarate reductase with Nizatidine and comparison with the inhibitory effect some Yarrow compounds of the plant to enhance the effects of Metronidazole on Helicobacter pylori in Insilico
[
Vol.8,
Issue
28
- WinterYear
1397]
V
Vakili.Mohammad
Theoretical and experimental tautomerism study of para-Trifluorobenzoylacetone halogen derivatives using DFT and vibrational spectroscopy
[
Vol.9,
Issue
29
- SpringYear
1398]
Vakili.Mohammad
Investigation of the IntraMolecular Hydrogen Bonding in Halo, Methoxy, and Cyano-Malonealdehyde Derivatives
[
Vol.9,
Issue
31
- AutumnYear
1398]
Vakili.Mohammad
Tautomerization and Intramolecular Hydrogen bond Strength of para Chlorine-Benzoylacetone by Quantum Computation and Spectrometry Results
[
Vol.7,
Issue
22
- SummerYear
1396]
Y
Yari Pilambaraee.Nima
Preconcentration of trace Co (II) in water samples using modified Multiwall nano tube carbon
[
Vol.11,
Issue
36
- AutumnYear
1400]
Yari Pilambaraee.Nima
Dispersive Solid phase exteraction of trace Cu (II) in water samples using modified Nano Geraphene Oxide and determination by FAAS
[
Vol.12,
Issue
39
- AutumnYear
1401]
Yari Pilambaraee.Nima
Extraction of drugs in water Samples by Carbon Nanotubes modified and Measurement with Ultraviolet-Visible Spectrometry
[
Vol.8,
Issue
26
- SummerYear
1397]
Yari Pilambaraee.Nima
Solid Phase Extraction of Fluoxetine in water Samples by Carbon Nanotubes modified and its determination with Ultraviolet-Visible Spectrometry in Biological Samples
[
Vol.8,
Issue
28
- WinterYear
1397]
yari.mohammad
Solid Phase Extraction of Fluoxetine in water Samples by Carbon Nanotubes modified and its determination with Ultraviolet-Visible Spectrometry in Biological Samples
[
Vol.8,
Issue
28
- WinterYear
1397]
yari.mohammad
Extraction of drugs in water Samples by Carbon Nanotubes modified and Measurement with Ultraviolet-Visible Spectrometry
[
Vol.8,
Issue
26
- SummerYear
1397]
Yari.Mohammda
Preconcentration of Amlodipine using Fe3O4@MWCNT- chitosan compositeand determinated
by UV-Visb in biologycal samples
[
Vol.9,
Issue
30
- SummerYear
1398]
Yazdanpanah.Hassan
Review on mycotoxins determination by infrared spectroscopy and chemometrics in Food stuff
[
Vol.9,
Issue
32
- WinterYear
1398]
yousefzadeh.behrooz
Study and comparison of Equilibrium vs. resonance in keto-enol tautomerization in some piroxicam derivatives
[
Vol.7,
Issue
22
- SummerYear
1396]
Z
Zahedi.Ehsan
Theoretical Study on the Kinetics and Thermodynamics of the Tandem Cope-Type Hydroamination and [2,3]- Meisenheimer Rearrangement Sequence
[
Vol.12,
Issue
38
- SpringYear
1401]
Zahedi.Ehsan
Energetic and electronic properties of bilirubin photoisomerization products using density functional theory
[
Vol.12,
Issue
39
- AutumnYear
1401]
Zahedi.Ehsan
Theoretical investigation of Curtius rearrangement of oxalyl di azide molecule using quantum calculations in gas phase and solution
[
Vol.11,
Issue
35
- SummerYear
1400]
Zahedi.Mansoureh
Investigation of intramolecular hydrogen bond in Anthranilic acid derivatives
[
Vol.7,
Issue
23
- AutumnYear
1396]
Zand.M|ohammad Erfan
Investigating the effect of external electric field on the neurotransmitters acetylcholine, dopamine, GABA, glutamate and serotonin using density functional theory method
[
Vol.13,
Issue
41
- SpringYear
1402]
Zanjanchi.Farzaneh
The use of DFT computational method to study the effect of physical factors on the pH range of color change of Azo indicator: Methyl red and Methyl Orange
[
Vol.11,
Issue
35
- SummerYear
1400]
Zare yousefkhani.Hadi
Investigation of the IntraMolecular Hydrogen Bonding in Halo, Methoxy, and Cyano-Malonealdehyde Derivatives
[
Vol.9,
Issue
31
- AutumnYear
1398]
Zarei.Saeed
Theoretical study of the doping effects of iron and titanium atoms on the adsorption behavior of carbon nanosheet
[
Vol.11,
Issue
37
- WinterYear
1400]
Zarkoob.Fatemeh
Cu (I)-Catalyzed C-C and C-N Coupling Reactions from a Theoretical Point of View
[
Vol.9,
Issue
32
- WinterYear
1398]
Zhiani.Rahele
Synthesis of new magnetic FeNi3 / SiO2 / PPA magnetic nanocatalysts in tetrahydrobenzo [a] xanthene-11-ones reaction under solvent-free conditions
[
Vol.9,
Issue
30
- SummerYear
1398]
Zhiani.Rahele
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
[
Vol.12,
Issue
40
- WinterYear
1401]
Zhiani.Rahele
Synthesis 3a, 4-dihydronaphtho [2, 3-c] furan-1(3H)-one in the presence of CO2 and NiCo2O4 Nano catalyst
[
Vol.13,
Issue
42
- SummerYear
1402]