List of Articles CO

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  1 - QSAR study of camptothecin derivatives as anticancer drugs using genetic algorithm and multiple linear regression analysis
  fatemeh shafiei Shahaboddin Mohebbi Tahereh Momeni Isfahani Mehdi Ahmadi Sabegh
  10.30495/jptc.2023.71661.1252
• Open Access Article
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  2 - Ultrasonic Assisted Removal of humic acids (HAs) from aqueous solutions on Uultrasonically polysulfone/ X% Fe2O3 mixed matrix membrane, An Experimental Design Methodology
  Fereydoon Khazali Shahnaz Davoudi
  10.30495/jptc.2023.72322.1258
• Open Access Article
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  3 - A computational chemistry investigation of the intermolecular interaction between ozone and isothiocyanic acid (HNCS)
  Morteza Rouhani
• Open Access Article
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  4 - The Possibility of Selective Adsorption and Sensing of the Noble Gaseous Species by the C20 Fullerene, the Graphene Sheets, and the N4B4 Cluster
  Parvaneh Pakravan
• Open Access Article
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  5 - Investigating the Effect of Fullerene (C20) Substitution on the Structural and Energetic Properties of Tetryl by Density Functional Theory
  Mohammad Jalali Sarvestani Roya Ahmadi
• Open Access Article
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  6 - Determination of Trace Amount of Zn2+ Ion in soil, blood and vegetable and water samples by Flame Atomic Absorption Spectrometry After Cloud Point Extraction Using Selective Synthesis Ligand2-(3- indolyl) – 4,5 di phynyl imidazole.
  gholamhossein vatankhah hboube ebrahimi darush jafari
• Open Access Article
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  7 - Reactivity and aromaticity of hexasiline derivatives Si6XH5 (X = H, F, Cl, Br, COOH, NO2, NH2, CH3 and tBu)
  Mehdi Nabati
• Open Access Article
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  8 - Investigation of shear stability of commercial polymer of viscosity index improver for determination of engine oil optimal formulation
  Mehran Aghaie Mazandarani E. Sadeghi ghari H.
• Open Access Article
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  9 - The Use of Corn cob Micro Powder as a Low Cost Adsorbent, for the Removal of Co2+Ion from Aqueous Solutions and from the View Point Thermodynamics
  gholamali haghdoost
• Open Access Article
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  10 - Removal of Basic Dye Bromophenol Blue from aqueous solution by Electrocoagulation using Al – Fe Electrodes: Kinetics, Equilibrium and Thermodynamics Studies.
  Abideen Adeogun B Babu
• Open Access Article
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  11 - Theoretical structural analysis of 3-CHLORO-4-FLUORO-ANILINE.
  Muhammad Aziz Sohail Nadeem Muhammad Anwar
• Open Access Article
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  12 - Effect of Fe3+–MMT on thermal degradation and mechanical behavior of PVP/Amylose nanocomposite films
  naser sadeghpour orang Reza Abdollahi
• Open Access Article
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  13 - Elimination of Reactive Red 120 (RR-120) Dye from Aqueous Solution by the using of Date Cores Particles
  gholamali haghdoost
• Open Access Article
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  14 - Ultrasonic Assisted Removal of Methyl Paraben on Ultrasonically Synthesized Zn(OH)2-NPs-AC: Experimental Design Methodology
  Amir Abbas Ghazali
  10.30495/jptc.2021.20874
• Open Access Article
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  15 - Ultrasonic Assisted Adsorption of Crystal Violet (CV) Dye by CM-β-CD-Fe3O4NPs Synthesis: Experimental Design Methodology
  Ali Omaniziarati Gholamhossein Vatankhah
  10.30495/jptc.2021.20426
• Open Access Article
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  16 - Effects of Laser Process Parameters on Geometrical Characteristics of Aluminized Inconel738 superalloy by laser cladding
  bita mottaghi golshan mohammad mehdi Hadavi monireh ganjali
  10.30495/jptc.2021.20404
• Open Access Article
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  17 - Structural Relationship Study of Octanol-Water Partition Coefficient of the Compounds in kesum Essential Oil Using GA-MLR and GA-ANN Methods
  Atefehsadat Navabi Tahereh Momeni Isfahani
  10.30495/jptc.2021.20873
• Open Access Article
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  18 - Investigating the Performance of Membrane PEEK/PVA Modified with ZnO Nanoparticles in the Permeability and Selectivity of CO2/N2
  Arezoo Ghadi Ahmad Bahreini Mojtaba Masoumi
  10.30495/jptc.2023.71009.1247
• Open Access Article
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  19 - Response Surface Methodology for Removal of Butyl Paraben Dye Using Zeolitic Imidazolate-67 Modified by Fe3O4 Nanoparticles from Aqueous Solutions
  Arezoo Ghadi Mohammad Pourmohammad Ali Aghababai Beni
  10.30495/jptc.2023.71309.1250
• Open Access Article
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  20 - The Molecular Docking and Molecular Dynamics Simulation of Some HIV-1 protease Inhibitors For the treatment of Coronavirus Disease-19
  ghasem ghasemi babak motahary robabe Sayadikordabadi Asghar Alizadehdakhel
  10.30495/jptc.2023.65656.1233
• Open Access Article
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  21 - Investigation the Dependence of Mobility on Carrier Concentration and Temperature in Organic Semiconductors
  Ali Mahmoudloo
  10.30495/jptc.2023.70455.1244
• Open Access Article
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  22 - Analytical assessment of steel cord drawing lubricant with and without triple mixed-additive addition
  Farinaz Shahimi
  10.30495/jptc.2023.71371.1251
• Open Access Article
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  23 - Computational Design and Synthesis of Molecular Imprinted Polymers for solid-phase Extraction of Acyclovir
  gholamali haghdoost
  10.30495/jptc.2023.70690.1246
• Open Access Article
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  24 - The Study of Optical Properties Exciton Based of Molecular Quantum Dot
  Ali Mahmoudloo
  10.30495/jptc.2023.71763.1253
• Open Access Article
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  25 - Elimination of Congored from Aqueous Solution by the using of gamma alumina nanoparticles
  gholamali haghdoost
  10.30495/jptc.2023.71780.1256
• Open Access Article
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  26 - Theoretical Study of Flavopiridol Binded to Transition Metals
  M. Monajjemi1 H. Passdar L. Saedi R. Ghiasi F. Mollaamin
• Open Access Article
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  27 - A conceptual framework chemistry of Hydrated Cations: Part I. Preliminary Ab Initio and QTAIM calculations on [Li(H20)nr (n=1,2,3).
  Jamshid Najafpour Gholam Hossein Shafiee Abdolreza Sadjadi Shant Shahbazian
• Open Access Article
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  28 - Theoretical Analysis on the Conformational Features of the HCO—Gly—L—Leu—NH2 Protected Dipeptide Motif: Ab initio and DFT Exploratory
  B. Chahkandi M. Chahkandi S. M. Sadati Amin M. Giahi
• Open Access Article
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  29 - Investigation of relationship with electron configuration of chemical hardness, absolute electronegativity and electrophilicity
  Savas, Kaya Cemal Kaya
• Open Access Article
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  30 - Theoretical Study of Exo-Endo Interconversion of [(R)Ca1ixTMS2]Sn
  Avat (Arman) Taherpour
• Open Access Article
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  31 - NBO Analysis of Structural and Electronic Properties in B30N20
  Rahim Esmkhani Majid Monajjemi
• Open Access Article
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  32 - Platinium-Ruthenium electrocatalyst as sensor electrode for methanol oxidation
  Mohammad Yari Sajjad Sedaghat
• Open Access Article
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  33 - The kinetic study of the AZo Dye Decolourisation by advanced oxidation process
  Azam ALEBOYEH Hamid ALEBOYEH
• Open Access Article
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  34 - Experimental and theoretical studies on green and efficient deoximation using H202 catalyzed by Montmorillonite-K10 supported MnC12
  M. Mahmoodi Hashemi A. Ezabadi Gh.R. Najafi F. Mollaamin M. Khaleghian R. Zhiani
• Open Access Article
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  35 - Quantum mechanics investigation of acid dissociation constant of carboxylic acids in aqueous solution
  M. Khaleghian Gh. R. Ghashami
• Open Access Article
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  36 - Interaction of Dioxovanadium(V) Ion with Methionine at Different Ionic Strengths
  M. Kia F. Gharib G. Ghasemi
• Open Access Article
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  37 - Response of semi-empirical and AB initio methods to angle strain and conjugation effects in (Z,Z,Z)-Cycloocta-1,3,5-triene
  Issa Yavari Hassan Kabiri-Fard
• Open Access Article
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  38 - Topological Analysis of Theoretical Charge Density of Alkali Metal Cations (LC, Na+, le)ICrown Ether (18e6) Complexes
  J. Narafpour A. Sadjadi
• Open Access Article
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  39 - AB Initio Calculations of NMR Spectra for H20114C9N4 As A New Nanosemiconductor Molecule
  E. Pournamdari M. Monajjemi
• Open Access Article
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  40 - Structural Relationship Between Randić Indices, Adjacency, Distance Matrixes and Molar Absorption Coefficient of Linear Conjugated Polyene Compounds
  Avat (Arman) Taherpour Fatemeh Shafiee
• Open Access Article
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  41 - Hydrolysis of cadmium cation in different ionic strength
  Farahnaz Soleimani Hossein Aghaie Farrokh Gharib
• Open Access Article
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  42 - Electronic transport in Si and Au monoatomic chains considering strongly correlation effect, a first principle study
  Mansoureh Pashangpour Vahid Ghaffari
• Open Access Article
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  43 - Synthesis and Characterization of PbTiO3 Nanopowders by Citric Acid Gel Method
  K. Zare M. S. Sadjadi M. Enhessari S. Khanahmadzadeh
• Open Access Article
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  44 - Kinetic study on the electrodecolorization of C.I. Acid Yellow 23
  N. Modirshahla M.A. Behnajady S. Kooshaiian
• Open Access Article
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  45 - Selective and stable adhesion of Yeast cells to Boronate-containing Polymer Grafted to glass Supports
  H.A Panahi A.E. Ivano I.Y Galaev Bo. Mattiasson H.S Waqif M. Jahanshahi
• Open Access Article
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  46 - The Structural Relationship Between Topological Indices and Some Thermodynamic Properties
  F. Shafiei M. Aghaie K. Zare H. Aghaie
• Open Access Article
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  47 - Ab Initio Study of Conformational and Configurational Properties of 1, 3- Diazacyclohepta-1, 2-diene and 1, 3-Diazacycloocta-1, 2-diene
  Issa Yavari Vahideh Hadigheh-Rezvan Mohsen Dadgar
• Open Access Article
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  48 - Decontamination of DMMP by adsorption on ZnO, A Computational Study
  F. R. Nikmaram J. Najafpour M. Ashrafi Shahri
• Open Access Article
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  49 - Thermodynamic study of Cu(II) ion-selective membrane electrode based on his (N-salicylidene-3,32-diamino dip hen y sulfone
  E. Baghdar F. Fekri dar M. Giahi S. Farhadi M. Aghaie
• Open Access Article
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  50 - In-situ synthesis and characterization of conducting metal — polyaniline nanocomposites
  M. Yari S. Sedaghat
• Open Access Article
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  51 - Metal ions binding study on human growth hormone by isothermal titration calorimetric method
  A.A. Saboury MS. Atri
• Open Access Article
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  52 - NMR and Solvent Effect Study on the Active Site of Oxidized Azurin
  K. Shahanipour T. Nejad Salari F. Mollaamin M. Monajjemi
• Open Access Article
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  53 - Sorption stuck). of C.I. Acid Red 88 from aqueous solutions onto sawdust
  N. Modirshahla M. A. Behnajady A. Shamel R. Eskandari
• Open Access Article
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  54 - Complexation of alkali metal ions by totrapropary-monoamine and tetrabutoxytriamine utak] arenes
  Noushin Osouleddini Karim Zare
• Open Access Article
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  55 - Ab initio and DFT studies on tautomerism of 5-methyl cytosine in gaseous phase
  K. Zare M. Monajjemi E. Zahedi H. Aghaie
• Open Access Article
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  56 - Physicochemical Properties of a Frolic Ionic Liquid: Ethylammonium Propionate
  M. Sadri F. Sadeghzadeh Darabi S. Ahmadvand
• Open Access Article
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  57 - Effect of Catalyst on the Growth of Diamond-like Carbon by HFCVD
  M. Aghaie M. Ghoranneviss Z. Purrajabi
• Open Access Article
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  58 - Response Surface Methodology for Removal of Methyl Violet Dye Using Albizia Stem Bark Lebbeck Modified by Fe2(MoO4)3 Nanocomposite from Industrial Wastewater
  
  10.30495/jptc.2022.21450
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  59 - Solvent effects on protonation and complexation of histidine with molybdenum (VI) at different aqueous solutions of methanol
  Farrokh Gharib Nayyer Farkhad-Aali
• Open Access Article
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  60 - A model for modified electrode with carbon nanotube composites using percolation theory in fractal space
  H. Baheri H. Aghaie
• Open Access Article
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  61 - Computation of the NMR Parameters of H-Capped (10,0) and (5,5) Single-Walled SiC Nanotubes
  Goudarz M. Rouzbehani Temer S. Ahmadi Ahmed Seif
• Open Access Article
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  62 - Theoretical study of catalytic reduction of CO2 with H20 by BOC-MP method
  B. Khezri K. Zare H. Aghaie
• Open Access Article
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  63 - Ionic Strength Dependence of Formation Constants: Complexation of Dioxouranium (VI) with Aspartic Acid
  Farrokh Gharib Karim Zare Ramin Cheraghali
• Open Access Article
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  64 - Synthesis and investigation the thermal behavior thermodynamically of new metal Complex of Cobalt nitrate
  
• Open Access Article
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  65 - Thermodynamic study of Ion pairing in Aqueous solution of 〖BaF〗_2 by (_^19)F-NMR
  H. Aghaie A. Aliabadi B. Sohrabi M. Aghaie M. R. Sohrabi
• Open Access Article
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  66 - Computational studies of carbon decorated boron nitride nanocones
  A. Nouri M. Mirzaei M. Yousefi
• Open Access Article
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  67 - An Ab Initio SCF-MO Study of Conformational Properties of (Z)- Cyclooctene
  Issa Yavari Hassan Kabiri-Fard
• Open Access Article
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  68 - Poly zirconium chloride (PZC) as an efficient adsorbent for 99 MO
  H. Salehi M. Zoghi M. Alimoradi A. Niazi H. Abbasi
• Open Access Article
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  69 - Theoretical and Conformational Study of Pinched-cone Interconversion in monosubstituted tri-methylsilyle ethynyl Derivative of Calix[4]arene
  Saeed Taghavaei-Gangali Saeed Taghvaei-Gangali shahram moradi Kambiz Tahvildari
• Open Access Article
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  70 - NMR and NBO Calculation of Broccoli Calm: Nano Physical Parameter Study
  M. Monajjemi M. Ahmadianarog
• Open Access Article
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  71 - Complexation of Calcium and Barium Cations by Calix[4]arene-bis-crown-6
  Poupak Khazaeli-Parsa Mehran Aghaie Karim Zare Azar Bouzaripour
• Open Access Article
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  72 - Ab initio interaction potential of methane and carbon dioxide: Calculation of second-virial coefficient
  M. Aghaie F. Naderi A. Menatian
• Open Access Article
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  73 - An Ab Initio SCF-MO Study of Conformational Properties of Cyclodeca-1,2,3-triene
  Issa Yavari Hassan Kabiri-Fard
• Open Access Article
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  74 - Spectrophotometric Determination of Protonation Constants of T ry p to ph an at Different Ionic Strengths and Various Ionic Media
  Al' Shamel Masumeh Asgharian Farrokh Gitarib
• Open Access Article
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  75 - The Study of Salvation Effects on an Anticancer Drug; Dammarane sapogenins
  M. Hooshyari F. Naderi M. Yari M. Khaleghian M. Monajjem
• Open Access Article
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  76 - Fluorescent Method for Determination of residue toxic Insecticide Abamectin Using PbS Quantum Dots-Based Gelatin in Water Samples
  
  10.30495/jptc.2021.21445
• Open Access Article
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  77 - Structural investigation of complexes formed by DNA+CTAB and DNA+DDAB and Designing a method to increase salt ions between DNA and the Surfactant rods.
  E. Moniri F. Gharib M. Monajjemi K. Zare
• Open Access Article
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  78 - Manganese (M-selective PVC membrane electrode based on N-(2- picolinamido ethyl)-Picolinamide as ionophore
  M. Zawari M. Giahi H. Aghaie
• Open Access Article
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  79 - Experimental and theoretical studies on efficient regeneration of carbonyl compounds from oximes under green, mild and completely heterogeneous nanocatalysis
  Gh.R. Najafi M. Saffari M. Masteri-Farahani F. Mollaamin
• Open Access Article
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  80 - Thermodynamic study of interaction between phthalocyanines with calf thymus DNA
  M. Aghaie F. Naderi M. Monajjemi H. Aghaie N. Safari P.R. Jamaat
• Open Access Article
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  81 - Purification and Characterization of Milk Clotting Enzyme Produced by Rhizomucor Rmiehei
  Sh. Khalil Moghaddam M. Khaleghian F. Naderi M. Azin M. Monajjemi
• Open Access Article
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  82 - Spectrophotometric Determination of Hg2+ after Solid Phase Extraction on Microcrystalline Naphthalene
  M. Reza Shishehbore Navid Nasirizadeh A. Mohammad Akhoundi
• Open Access Article
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  83 - Quantitative structure—retention relationship analysis of nanoparticle compounds
  H. Noorizadeh A. Farmany
• Open Access Article
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  84 - The comparison synthesis of CuNiO2 nanoparticles prepared by sol-gel auto-combu on, microwave and co-precipitation techniques
  S. A. Khorrami N. Naderfa M. G. G Mojadad
• Open Access Article
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  85 - Ionic str4ength dependence of formation constants, complexation of Glycine with dioxouranium (VI) Ion
  Farrokh Gharib Ali Shamel Farbod Lotfi
• Open Access Article
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  86 - Determination of water quality parameters and nutrient level with an Adaptive Neuro- Fuzzy Inference System
  Maryam Hosseini Jalal Javadi moghaddam
• Open Access Article
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  87 - Stability Constants of Dioxy Vanadium(V)-Glycylglycine System and a Related Calculating Model
  M. Aghaie H. Aghaie K. Zare
• Open Access Article
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  88 - Equilibrium Constants of the Complexation of Molybdate Ion with para-Sulfonatocalix [4] arene in aqueous media
  S. Z. Hashemizade Ali Farajtabar
• Open Access Article
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  89 - CO Adsorption on the V (100) Surface: A Density Functional Study
  F. Mollaamin M.T. Baei A. Kazemi Babaheydari
• Open Access Article
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  90 - A simulation study of calcium release channel
  M. Monajjemi H.H. Haeri S.M. Hashemianzadeh M. Gholami K. Zare
• Open Access Article
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  91 - Theoretical Investigation of Solvent Effects on The Structural Changes of I - Pentadeeanoyl - 2 - Docosahexaenoyl - Sn - Glycerol -3 -Phosphoeholin
  N. Khodayari B. Honarparvar M. Monajjemi K. Parivar
• Open Access Article
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  92 - SYNTHESIS, X-RAY CRYSTAL STRUCTURE AND IR STUDY OF NEW TRINUCLEAR, BASE CARBOXSYLATE COMPLEX OF [Cu3O(OAc)6(H2O)3]Cl.CH3OH.6H2O
  Massoud Rafizadeh
• Open Access Article
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  93 - Density Functional Theory Studies of Defects in the (5,5) Silicon Nanotube
  M. Ilkhani M. Mirzaei
• Open Access Article
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  94 - Preparation and Evaluation of NiFe204 and CuFe204 Nanoeatalysts by Combination of Sol- Gel Auto-Combustion Method and Irradiation Technique
  S. A. Khorrami S. A. Sepehr S. Manie G. Mahmoudzadeh S. Madani S. Moradi A. M. Sharif F. Gharib R. Lotfi
• Open Access Article
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  95 - A Theoretical Investigation of Kinetics and Mechanism of Aza-Cope Rearrangement
  M. R Zardoost S. A. Radati H. Davoudi M. R. Gholami H. Aghaei
• Open Access Article
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  96 - Thermodynamics of the solubility of potassium nitrate in the mixed solvent, Ethanol+Water, and the related Ion-association
  M. Aghaie F. Ghaemi Amiri M. Giahi
• Open Access Article
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  97 - Thermodynamics of Ion Association in the Saturated Solution of The Mixed Solvent (methanol+water) and Ion Pairing at 25.0°C
  M. Aghaie S. Moradian
• Open Access Article
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  98 - Study of Catalyst and Co- Catalyst Effect on Preparation of Lubricant from Heavy Propylene Tetramer (HPT)
  Omid Moradi Mohammad Yari S. Sedaghat
• Open Access Article
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  99 - N-phenylaza-15-crown-5 as Ionophore in PVC-Matrix for Fe2+ - Selective Sensor
  M. Aghaie M. Giahi H. Aghaie M. Pournaghdy
• Open Access Article
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  100 - AB Initio Study of Molecular Struture, Energetic and Vibrational Spectra of (GaN)4 Nanosemiconductor
  E. Poumamdari M. khaleghian
• Open Access Article
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  101 - Thermodynamic Study on the Interaction between Fe2+(aq) ion and LAlanine
  K. Zare F. Keshavarz Rezaie F. Soleimani H. Aghaie
• Open Access Article
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  102 - Thermodynamic Study and Total Energy Calculation for three systems of Enol↔Keto Tautomerism
  H. Aghaie M. Monajjemi L. Papei
• Open Access Article
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  103 - Quantitative Correlation of Randić Indices and Adjacency Matrixes With Dewar Resonance Energy of Annulene Compounds
  A. Taherpour F. Shafiee
• Open Access Article
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  104 - Theoretical study of molecular mechanics methods on clonidine drug-carbon nano cone
  Zohreh Yousefian Karim Zare
• Open Access Article
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  105 - A Density Functional Theory Study of Structure of Phosphonic Acid
  M.H. Ghorbani H. Aghaie M. Aghaie
• Open Access Article
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  106 - Thermodynamic Studies on the Interaction of Phthalocyanine with Bovine serum albumin
  K. Zare H. Aghaie M. Mirzaie M.R. Zardoost F. Khazali
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  M. Aghaie H. Aghaie A. Ebrahimi
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  109 - Non- Ideality and Ion-Pairing in Saturated Aqueous Solution of Lithium Carbonate at 25°C
  M. Aghaie B.Sh. Broojeni
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  110 - Nanoparficks of Silver loaded on polyanilino and Nylon
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  111 - Synthesis, Characterization, and Crystal Structure Determination of Iron(III) Hetero-ligand Complex Containing Chloride, Dimethyl sulfoxide, pyridine-2, 6-dicarboxylate and Water, [Fe(Pydc)(DMSO)(H2O)Cl]
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  112 - Theoretical study of intermolecular potential energy and second virial coefficient in the mixtures of CH4 and H2CO gases
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  113 - The effect of dielectric constant and ionic strength on the solubility of lithium carbonate at 25.0 °C in thermodynamic view
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  114 - The effect of polar copolymers in protein absorption on contact lenses on 2-Hydroxyethyl methacrylate(HEMA)
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  116 - The hydrothermal synthesis and X-ray crystal structure of Ag (1)-4, 4"-bipyridine-based coordination polymer
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  117 - The Solubility of Potassium Sulfate in Thermodynamic view
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  118 - New Synthesis of Polyaniline using a Peroxides Enzyme
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  119 - Determination of the stability constant of Cobalt (ІІ) – Piroxicam complex by spectrophotometery
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  126 - An ab initio study of metalated CMP,UMP& dTMP at HF level:Bond energies and isotropic NMR shielding of atoms
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  127 - Study on the Interaction of Dioxovanadium(V) with Nitrilotriacetic Acid at Different Ionic Strengths by Using Extended Debye-Hiickel Equation
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  133 - X-ray Charge-Dens Study of 5-Chloro-8-hydroxy-6-methyloaphthalene-l.4-dione: A Hydroxynaphthoquinone Derivative
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  142 - Interaction of Thallium (I) with Cytidine 5
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  143 - Synthesis, Identification and Calculation of Complex Crystallographic Structure of Cobalt (II) with theLigand Heterocyclic Derived from Pyridine
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  144 - Electronic Properties of Hydrogen Adsorption on the Silicon- Substituted C20 Fullerenes: A Density Functional Theory Calculations
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  149 - Estimating the second virial coefficients of some real gas mixtures and related thermodynamic views
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