Number of Articles: 341
151. Rectification Ratio Enhancement and Functionalized Pyrene: DFT+NEGF

Volume 6, Issue 2, Spring 2018, Pages 309-321

Sadegh Afshari; Jaber Jahanbin Sardroodi

Rectification Ratio Enhancement and Functionalized Pyrene: DFT+NEGF


152. TiO2@CoFe2O4 Nanofiber for the Photocatalytic Degradation of Direct Red 80

Volume 7, Issue 2, Spring 2019, Pages 309-325

Soheil Yasini Ardakani; Ramin Abghari; Mohammad Mirjalili

TiO2@CoFe2O4 Nanofiber for the Photocatalytic Degradation of Direct Red 80


153. Biological Applications of Isothermal Titration Calorimetry

Volume 3, Issue 4, Autumn 2015, Pages 319-330

Maliheh Sadat Atri; Ali Akbar Saboury; Faizan Ahmad

Biological Applications of Isothermal Titration Calorimetry


154. Prediction of Fe-Co-Mn/MgO Catalytic Activity in Fischer-Tropsch Synthesis Using Nu-support Vector Regression

Volume 4, Issue 3, Summer 2016, Pages 391-405

Ali Akbar Mirzaei; Somayeh Golestan; Seyed-Masoud Barakati

Prediction of Fe-Co-Mn/MgO Catalytic Activity in Fischer-Tropsch Synthesis Using Nu-support Vector Regression


155. Molecular Dynamics Simulation and Free Energy Studies on the Interaction of Salicylic Acid with Human Serum Albumin (HSA)

Volume 5, Issue 3, Summer 2017, Pages 483-496

Leila Karami; Elham Tazikeh-Lemeski; Ali Akbar Saboury

Molecular Dynamics Simulation and Free Energy Studies on the Interaction of Salicylic Acid with Human Serum Albumin (HSA)


156. Novel N-heterocyclic Stannylenes (NHSns) Using DFT

Volume 7, Issue 3, Summer 2019, Pages 511-521

Amir Hosein Zamanzadeh; Nazanin Mohebi; Mohammad Zaman Kassaee; Peter Cummings; Kun Dong

Novel N-heterocyclic Stannylenes (NHSns) Using DFT


158. Cooperative and Diminutive Interplay between Halogen, Hydride and Cation-σ Interactions

Volume 4, Issue 4, Autumn 2016, Pages 583-589

Mohammad Solimannejad; Seyyedeh Marziyeh Hosseini; Abedin Zebardasti

Cooperative and Diminutive Interplay between Halogen, Hydride and Cation-σ Interactions


159. Diesel Oil Upgradation by Ultrasound Irradiation: A Study on the Effects of Main Operational Parameters

Volume 5, Issue 4, Autumn 2017, Pages 691-707

Arash Shamseddini; Fereidun Esmaeilzadeh; Dariush Mowla

Diesel Oil Upgradation by Ultrasound Irradiation: A Study on the Effects of Main Operational Parameters


160. Pb(II) Removal from Synthetic Wastewater Using Kombucha Scoby and Graphene Oxide/Fe3O4

Volume 6, Issue 4, Autumn 2018, Pages 759-771

Seyyed Mojtaba Mousavi; Seyyed Alireza Hashemi; Ali Mohammad Amani; Hossein Esmaeili; Younes Ghasemi; Aziz Babapoor; Fatemeh Mojoudi; Omid Arjomand

Pb(II) Removal from Synthetic Wastewater Using Kombucha Scoby and Graphene Oxide/Fe3O4


161. Ortho-phenylenediamine Based Bis-ureas as the Ion Selective Sensors; A QM/MD Study

Volume 7, Issue 4, Autumn 2019, Pages 785-797

Mohammad Khavani; Mohammad Izadyar

Ortho-phenylenediamine Based Bis-ureas as the Ion Selective Sensors; A QM/MD Study


162. Secondary Structure Effects on the Acidity of Histidine and Lysine-Based Peptides Model; A Theoretical Study

Volume 3, Issue 1, Winter 2015, Pages 67-77

Mohammad Izadyar; Mohammad reza Housaindokht; Neda Zavvar; Mohammad Khavani; Adel Reisi-vanani

Secondary Structure Effects on the Acidity of Histidine and Lysine-Based Peptides Model; A Theoretical Study


163. Conformational analysis of N- and C-terminally protected tripeptide model glycyl-isoleucine-glycyl: An ab initio and DFT study

Volume 2, Issue 1, Spring 2014, Pages 68-75

Behzad Chahkandi; Mohammad Chahkandi; Bentolhoda Ashrafi

Conformational analysis of N- and C-terminally protected tripeptide model glycyl-isoleucine-glycyl: An ab initio and DFT study


164. The effect of some mono and bivalent metal cations on the individual hydrogen bond energies in A−T and G−C base pairs

Volume 1, Issue 1, Spring 2013, Pages 81-89

Hojat Delarami; Ali Ebrahimi; Mostafa Habibi Khorassani; Somaye Abedini; Najmeh Mostafavi

The effect of some mono and bivalent metal cations on the individual hydrogen bond energies in A−T and G−C base pairs


165. New Activated Carbon from Persian Mesquite Grain as an Excellent Adsorbent

Volume 5, Issue 1, Winter 2017, Pages 81-98

Ensieh Ghasemian Lemraski; Soheila Sharafinia; Masoud Alimohammadi

New Activated Carbon from Persian Mesquite Grain as an Excellent Adsorbent


166. Products of the Self-Reaction of HCO Radicals: Theoretical Kinetics Studies

Volume 7, Issue 1, Winter 2019, Pages 81-94

Vahid Saheb; Afsaneh Nazari


168. A New Thermodynamic Approach for Protein Partitioning in Reverse Micellar Solution

Volume 6, Issue 1, Winter 2018, Pages 105-113

Shahriar Osfouri; Tuba Tayebi; Reza Azin

A New Thermodynamic Approach for Protein Partitioning in Reverse Micellar Solution


169. Removal of Azo Dye Calcon Using Polyaniline Films Electrodeposited on SnO2 Substrate

Volume 8, Issue 1, Winter 2020, Pages 111-124

Mohammed Ait Himi; Sanae El Ghachtouli; Amina Amarray; Zaina Zaroual; Patrick Bonnaillie; Mohamed Azzi

Removal of Azo Dye Calcon Using Polyaniline Films Electrodeposited on SnO2 Substrate


171. An Accurate Empirical Correlation to Estimate Sonic speed of Ionic Liquids

Volume 3, Issue 2, Spring 2015, Pages 169-178

Mohammad Hasan Vakili; Ehsan Sanjari; Zahra Jali

An Accurate Empirical Correlation to Estimate Sonic speed of Ionic Liquids


173. Theoretical Study of Polyethylene Crystallization Using Modified Weighted Density Approximation (MWDA)

Volume 4, Issue 2, Spring 2016, Pages 209-219

Alireza Razeghizadeh; Vahdat Rafee

Theoretical Study of Polyethylene Crystallization Using Modified Weighted Density Approximation (MWDA)


174. Amphiphilic Block Copolymer Nano-micelles: Effect of Length Ratio of the Hydrophilic Block

Volume 3, Issue 3, Summer 2015, Pages 239-245

Narges Nikoofard; Fahimeh Maghsoodi

Amphiphilic Block Copolymer Nano-micelles: Effect of Length Ratio of the Hydrophilic Block


175. A Novel Poly(vinyl alcohol) Post-precipitation Template Synthesis and Property Tuning of Photoactive Mesoporous Nano-TiO2

Volume 8, Issue 2, Spring 2020, Pages 281-295

Abubakar Hamisu; Umar Gaya; Abdul Halim Abdullah

A Novel Poly(vinyl alcohol) Post-precipitation Template Synthesis and Property Tuning of Photoactive Mesoporous Nano-TiO2