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1

Therapeutic bacteria to combat cancer; current advances, challenges, and opportunities

Sedighi, Mansour, Zahedi Bialvaei, Abed, Hamblin, Michael R., Ohadi, Elnaz, Asadi, Arezoo, Halajzadeh, Masoumeh, Lohrasbi, Vahid, Mohammadzadeh, Nima, Amiriani, Taghi, Krutova, Marcela, Amini, Abolfaz

Journal:

Cancer Medicine

Year:

2019

Language:

english

File:

PDF, 550 KB

english, 2019

2

Towards Developing Efficient Metalloporphyrin-Based Hybrid Photocatalysts for CO 2 Reduction; An Ab Initio Study

Ostovan, Azar, Papior, Nick, Zahedi, Mansour, Moshfegh, Alireza Z.

Journal:

Physical Chemistry Chemical Physics

Year:

2020

File:

PDF, 4.67 MB

2020

3

Theoretical studies of biliverdin: energetics of the reduction pathways to bilirubin

Mansour Zahedi, Maryam Kamalipour, Nasser Safari

Journal:

Journal of Molecular Modeling

Year:

2002

Language:

english

File:

PDF, 90 KB

english, 2002

4

Phenomenal Properties of Gold Nanoclusters with No Chemical Interaction with O 2 : Field Effect and Electron Pumping

Moghaddasi, Ali, Zahedi, Mansour

Journal:

The Journal of Physical Chemistry C

Year:

2013

Language:

english

File:

PDF, 1.64 MB

english, 2013

5

Coupled Cluster and Quantum Monte-Carlo potential energy curves of the ground state of Be 2 and Be 2 + molecules

Nasiri, Saeed, Zahedi, Mansour

Journal:

Computational and Theoretical Chemistry

Year:

2017

Language:

english

File:

PDF, 1.26 MB

english, 2017

6

Comparative DFT Study To Determine if α-Oxoaldehydes are Precursors for Pentosidine Formation

Nasiri, Rasoul, Field, Martin J., Zahedi, Mansour, Moosavi-Movahedi, Ali Akbar

Journal:

Journal of Physical Chemistry A

Year:

2012

Language:

english

File:

PDF, 5.16 MB

english, 2012

7

Rate constants for CN reactions with hydrocarbons and the product HCN vibrational populations: Examples of heavy–light–heavy abstraction reactions

Copeland, Leon R., Mohammad, Fida, Zahedi, Mansour, Volman, David H., Jackson, William M.

Journal:

The Journal of Chemical Physics

Year:

1992

Language:

english

File:

PDF, 930 KB

english, 1992

8

Kinetics and mechanism of the permanganate-induced autocatalytic dehydration reaction of L-γ-amino-n-butyric acid to give 2-pyrrolidone through a radical intermediate in moderately concentrated acidic medium

Bahrami, Homayoon, Bigdeli, Moghadas, Davari, Mehdi D., Zahedi, Mansour, Moosavi-Movahedi, Ali A.

Journal:

Progress in Reaction Kinetics and Mechanism

Year:

2011

Language:

english

File:

PDF, 738 KB

english, 2011

9

Carboxylated single-walled carbon nanotubes as a semiconductor for adsorption of acrylamide in mainstream cigarette smoke

Yoosefian, Mehdi, Pakpour, Atef, Zahedi, Mansour

Journal:

Physica E: Low-dimensional Systems and Nanostructures

Year:

2020

File:

PDF, 1.56 MB

2020

10

Quantum Monte Carlo simulations using Slater-Jastrow-backflow wave function

Nasiri, Saeed, Zahedi, Mansour

Journal:

Computational and Theoretical Chemistry

Year:

2020

File:

PDF, 671 KB

2020

11

DFT/B3LYP study of the substituent effects on OH bond dissociation enthalpies of chroman derivatives in the gas phase and solvent environment

Meysam Najafi, Elyas Nazarparvar, Kaveh Haghighi Mood, Mansour Zahedi, Erik Klein

Journal:

Computational and Theoretical Chemistry

Year:

2011

Language:

english

File:

PDF, 585 KB

english, 2011

12

An ab initio investigation of sulfur diimides: stability of various conformers and conformational analysis part II. Dimethyl sulfur diimides (DMSD)

Mansour Zahedi, Shant Shahbazian, Seik Weng Ng

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

2003

Language:

english

File:

PDF, 149 KB

english, 2003

13

Density Functional Theory (B3LYP) Study of Substituent Effects on O–H Bond Dissociation Enthalpies of trans -Resveratrol Derivatives and the Role of Intramolecular Hydrogen Bonds

Nazarparvar, Elyas, Zahedi, Mansour, Klein, Erik

Journal:

Journal of Organic Chemistry

Year:

2012

Language:

english

File:

PDF, 2.20 MB

english, 2012

14

Structure and Redox Behavior of Iron Oxophlorin and Role of Electron Transfer in the Heme Degradation Process

Gheidi, Mahin, Safari, Nasser, Zahedi, Mansour

Journal:

Inorganic Chemistry

Year:

2012

Language:

english

File:

PDF, 4.46 MB

english, 2012

15

Effect of high aluminium intake on contractility of smooth muscle in rat

Malakooti Hashjin, Seyed Mansour, Asl, Saleh Zahedi

Journal:

Gastroenterology

Year:

2003

Language:

english

File:

PDF, 176 KB

english, 2003

16

Computational study for the circular redox reaction of N2O with CO catalyzed by fullerometallic cations C60Fe+ and C70Fe+

Anafcheh, Maryam, Naderi, Fereshteh, Khodadadi, Zahra, Ektefa, Fatemeh, Ghafouri, Reza, Zahedi, Mansour

Journal:

Journal of Molecular Graphics and Modelling

Year:

2017

Language:

english

File:

PDF, 2.33 MB

english, 2017

17

Addition of borazine to boron nitride nanotubes: [2+2] cycloaddition or bond cleavage

Anafcheh, Maryam, Ahmadi, Elaheh, Zahedi, Mansour

Journal:

Monatshefte für Chemie - Chemical Monthly

Year:

2019

File:

PDF, 882 KB

2019

18

Polyacenes electronic properties and their dependence on molecular size

Rohoullah Firouzi, Mansour Zahedi

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

2008

Language:

english

File:

PDF, 247 KB

english, 2008

19

Theoretical Study of Site Dependency on Charge Transfer at Au(111) Nanoclusters

Moghaddasi, Ali, Zahedi, Mansour, Watson, Philip

Journal:

The Journal of Physical Chemistry C

Year:

2012

Language:

english

File:

PDF, 4.75 MB

english, 2012

20

Fully and partially exohydrogenated Si80fullerene cage: a DFT study

Ghafouri, Reza, Anafcheh, Maryam, Zahedi, Mansour

Journal:

Structural Chemistry

Year:

2014

Language:

english

File:

PDF, 765 KB

english, 2014

21

Kinetics and Mechanism of the Permanganate-Induced Oxidative Catalytic Condensation of Sarcosine to a Diketopiperazine

Khatti, Zahra, Davari, Mehdi D., Bahrami, Homayoon, Zahedi, Mansour

Journal:

Progress in Reaction Kinetics and Mechanism

Year:

2010

Language:

english

File:

PDF, 881 KB

english, 2010

22

Accurate potential energy curves of Li2 and LiH: A Quantum Monte-Carlo (QMC) study

Nasiri, Saeed, Zahedi, Mansour

Journal:

Chemical Physics Letters

Year:

2015

Language:

english

File:

PDF, 2.03 MB

english, 2015

23

Activation modelling of β- and γ-class of carbonic anhydrase with amines and amino acids: Proton transfer process within the active site from thermodynamic point of view

Ghiasi, Mina, Hemati, Somaye, Zahedi, Mansour

Journal:

Computational and Theoretical Chemistry

Year:

2017

Language:

english

File:

PDF, 2.47 MB

english, 2017

24

Delayed autocatalytic behavior of Mn(II) ions at a critical ratio: The effect of structural isomerism on permanganic oxidation of L-norleucine

Homayoon Bahrami, Mansour Zahedi

Journal:

International Journal of Chemical Kinetics

Year:

2006

Language:

english

File:

PDF, 298 KB

english, 2006

25

Ab initio studies of BN-acenes and cyclo BN-acenes electronic properties and their dependence on the molecular size and the number of electrons

Rohoullah Firouzi, Shahin Sowlati Hashjin, Mansour Zahedi

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

2009

Language:

english

File:

PDF, 565 KB

english, 2009

26

N–N bond cleavage and ring expansion at the surface of exchange and substitutional antisite defective boron nitride nanotubes by boron cluster: A density functional theory study

Anafcheh, Maryam, Shahbaz, Nasrin, Zahedi, Mansour

Journal:

Year:

2019

Language:

english

File:

PDF, 2.13 MB

english, 2019

27

Theoretical investigations of the reactivity of verdoheme analogues: Opening of the planar macrocycle by amide, dimethyl amide, and hydroxide nucleophiles to form helical biliverdin type complexes

Homayoon Bahrami, Mansour Zahedi, Nasser Safari

Journal:

Journal of Inorganic Biochemistry

Year:

2006

Language:

english

File:

PDF, 409 KB

english, 2006

28

Corrigendum to “A theoretical investigation of electronic ground state of parent sulfur diimide” [J. Mol. Spectrosc. 223 (2004) 195–204]

Shant Shahbazian, Mansour Zahedi, Seik Weng Ng

Journal:

Journal of Molecular Spectroscopy

Year:

2006

Language:

english

File:

PDF, 69 KB

english, 2006

29

An in silico study on the ring-size effect in ring enlargement Bellus-Claisen rearrangement

Rahim Ghadari, Masoud Arabieh, Mansour Zahedi, Ahmad Shaabani

Journal:

Computational and Theoretical Chemistry

Year:

2012

Language:

english

File:

PDF, 600 KB

english, 2012

30

Unique 1?2 adduct formation of meso-tetraarylporphyrins and meso-tetraalkylporphyrins with BF3: a spectroscopic and ab initio study

Mohajer, Daryoush, Zakavi, Saeed, Rayati, Saeed, Zahedi, Mansour, Safari, Nasser, Khavasi, Hamid Reza, Shahbazian, Shant

Journal:

New Journal of Chemistry

Year:

2004

Language:

english

File:

PDF, 665 KB

english, 2004

31

Erratum: Rate constants for CN reactions with hydrocarbons and the product HCN vibrational populations: Examples of heavy–light–heavy abstraction reactions [J. Chem. Phys. 96 , 5817 (1992)]

Copeland, Leon R., Mohammed, Fida, Zahedi, Mansour, Volman, David H., Jackson, William M.

Journal:

The Journal of Chemical Physics

Year:

1992

Language:

english

File:

PDF, 246 KB

english, 1992

32

ChemInform Abstract: Resonance Stabilization Study of Some Fullerenes Cn (20 ≤ n ≤ 88): Is n = 32 a “Magic” Number?

Mansour Zahedi, Mohammed Al-Kobaisi

Journal:

Year:

1999

File:

PDF, 29 KB

1999

33

How tin metal prevents verdoheme ring opening? Comparative study of various nucleophiles

Mehdi D. Davari, Homayoon Bahrami, Mansour Zahedi, Nasser Safari

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

2009

Language:

english

File:

PDF, 602 KB

english, 2009

34

Comparison of the effects of sucrose molecules on alcohol dehydrogenase folding with those of sorbitol molecules on alcohol dehydrogenase folding using molecular dynamics simulation

Bahrami, Homayoon, Zahedi, Mansour

Journal:

Journal of the Iranian Chemical Society

Year:

2015

Language:

english

File:

PDF, 1.39 MB

english, 2015

35

Incorporation of topological defects and atomic impurities on the carbon nanotube surface: A DFT study of AD-dimer defects

Anafcheh, Maryam, Naderi, Fereshteh, Zahedi, Mansour

Journal:

Heteroatom Chemistry

Year:

2018

Language:

english

File:

PDF, 387 KB

english, 2018

36

Effect of the axial ligands on the structure and reactivity of tin verdoheme in the ring opening process

Mehdi D. Davari, Homayoon Bahrami, Mansour Zahedi, Nasser Safari

Journal:

Inorganica Chimica Acta

Year:

2010

Language:

english

File:

PDF, 530 KB

english, 2010

37

Modeling of biliverdin reduction process: regio-specificity and H-bonding

Mansour Zahedi, Mina Ghiasi, Nasser Safari

Journal:

Chemical Physics

Year:

2005

Language:

english

File:

PDF, 762 KB

english, 2005

38

Theoretical study of the substituent effects on O–H BDE oftrans-resveratrol derivatives in water and benzene: NBO analysis of intramolecular hydrogen bonds

Nazarparvar, Elyas, Zahedi, Mansour, Klein, Erik

Journal:

Structural Chemistry

Year:

2015

Language:

english

File:

PDF, 605 KB

english, 2015

39

Coupled Cluster and Quantum Monte-Carlo study of anionic hydrogen clusters

Mohammadi, Amin, Nasiri, Saeed, Zahedi, Mansour

Journal:

Chemical Physics Letters

Year:

2020

File:

PDF, 1.22 MB

2020

40

An ab initio/hybrid (ONIOM) investigation of biliverdin isomers and metal–biliverdin analogue complexes

Mansour Zahedi, Homayoon Bahrami, Shant Shahbazian, Nasser Safari, Seik Weng Ng

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

2003

Language:

english

File:

PDF, 251 KB

english, 2003

41

Theoretical study on the mono and multiply oxygenated Si 60 H 60 fullerene

Anafcheh, Maryam, Ghafouri, Reza, Ektefa, Fatemeh, Zahedi, Mansour

Journal:

Molecular Physics

Year:

2015

Language:

english

File:

PDF, 1.24 MB

english, 2015

42

Kinetics and mechanism of the dehydration reaction of sarcosine to a bislactame through diacyclperoxide intermediate in strong acidic medium

Homayoon Bahrami, Mehdi D. Davari, Maryam Keshavari, Mansour Zahedi, Ayoob Bazgir, Ali A. Moosavi-Movahedi

Journal:

International Journal of Chemical Kinetics

Year:

2009

Language:

english

File:

PDF, 291 KB

english, 2009

43

Quantum chemical investigation of intramolecular thione-thiol tautomerism of 1,2,4-triazole-3-thione and its disubstituted derivatives

Mehdi D. Davari, Homayoon Bahrami, Zahra Zolmajd Haghighi, Mansour Zahedi

Journal:

Journal of Molecular Modeling

Year:

2010

Language:

english

File:

PDF, 215 KB

english, 2010

44

Protective effect of rutin (vitamin p) against heme oxidation: A quantum mechanical approach

Mina Ghiasi, Afsaneh Azadnia, Masoud Arabieh, Mansour Zahedi

Journal:

Computational and Theoretical Chemistry

Year:

2012

Language:

english

File:

PDF, 997 KB

english, 2012

45

Exploration of the binding properties of the human serum albumin sites with neurology drugs by docking and molecular dynamics simulation

Alavi, Fatemeh S., Ghadari, Rahim, Zahedi, Mansour

Journal:

Journal of the Iranian Chemical Society

Year:

2017

Language:

english

File:

PDF, 2.22 MB

english, 2017

46

QM/MM study of the conversion of biliverdin into verdoheme by heme oxygenase

Alavi, Fatemeh Sadat, Zahedi, Mansour, Safari, Nasser, Ryde, Ulf

Journal:

Theoretica Chimica Acta

Year:

2019

Language:

english

File:

PDF, 2.66 MB

english, 2019

47

Differentiation of Brucella abortus and B. melitensis biovars using PCR- RFLP and REP-PCR

Amoupour, Moein, Nezamzadeh, Fatemeh, Zahedi bialvaei, Abed, Sedighi, Mansour, Jazi, Faramarz Masjedian, Alikhani, Mohammad Yousef, Mirnejad, Reza

Journal:

New Microbes and New Infections

Year:

2019

Language:

english

File:

PDF, 680 KB

english, 2019

48

Sustainable conversion of carbon dioxide to formic acid with Rh-decorated phosphorous-doped fullerenes: a theoretical study

Anafcheh, Maryam, Zahedi, Mansour

Journal:

Structural Chemistry

Year:

2020

File:

PDF, 1.27 MB

2020

49

A new mixed-ligand complex of copper(II) containing N-(2-pyridylmethyl)-2-pyrazinecarboxamide (NPyPzCa): Synthesis, molecular and crystal structure and properties of [Cu(NPyPzCa)(NO3)(DMSO)]

Hamid Reza Khavasi, Koroush Sasan, Shahin Sowlati Hashjin, Mansour Zahedi

Journal:

Comptes Rendus Chimie

Year:

2011

Language:

english

File:

PDF, 260 KB

english, 2011

50

Towards a complete basis set limit of Hartree–Fock method: correlation-consistent versus polarized-consistent basis sets

Shant Shahbazian, Mansour Zahedi

Journal:

Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta)

Year:

2005

Language:

english

File:

PDF, 152 KB

english, 2005

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