Nanocarbon-assisted biosensor for diagnosis of exhaled biomarkers of lung cancer: DFT approach
Nanocarbon-assisted biosensor for diagnosis of exhaled biomarkers of lung cancer: DFT approach

Mahmoud Mirzaei; Oguz Gulseren; Mohammad Rafienia; Amirhossein Zare

Volume 3, Issue 3 , March 2021, , Pages 154-161

Abstract
  Density functional theory (DFT) calculations were performed to investigate a nanocarbon-assisted biosensor for diagnosis of exhaled biomarkers of lung cancer. To this aim, an oxidized ...  Read More
Cytidine derivatives as inhibitors of methyltransferase enzyme
Cytidine derivatives as inhibitors of methyltransferase enzyme

Parnia Abyar Ghamsari; Marjaneh Samadizadeh; Mahmoud Mirzaei

Volume 2, Issue 4 , April 2020, , Pages 433-439

Abstract
  In this work, cytidine and fifteen of its derivatives have been examined to detect their Methyltransferase (MTF) enzyme inhibitory activity. 3D models of the ligands and MTF were extracted ...  Read More
A computational molecular approach on chitosan vehicle for metformin
A computational molecular approach on chitosan vehicle for metformin

Mahmoud Mirzaei; Oguz Gulseren; Elham Jafari; Mehdi Aramideh

Volume 1, Issue 4 , July and August 2019, , Pages 334-343

Abstract
  Density functional theory (DFT) calculations have been performed to study properties of chitosan (Chit) as a possible vehicle for carrying metformin (Met) drug. To this aim, the singular ...  Read More
Photosensitization of coronene–purine hybrids for photodynamic therapy
Photosensitization of coronene–purine hybrids for photodynamic therapy

Amir Hossein Rasouli Amirabadi; Mahmoud Mirzaei

Volume 1, Issue 4 , July and August 2019, , Pages 352-358

Abstract
  Photosensitization properties of coronene-purine (Cor-P) hybrids for photodynamic therapy (PDT) have been investigated in this work. Eight hybrid Cor-P models have been designed by ...  Read More
Cytidine derivatives as inhibitors of methyltransferase enzyme
Cytidine derivatives as inhibitors of methyltransferase enzyme

Parnia Abyar Ghamsari; Marjaneh Samadizadeh; Mahmoud Mirzaei

Volume 1, Issue 3 , May and June 2019, , Pages 310-317

Abstract
  In this work, cytidine and fifteen of its derivatives have been examined to detect their Methyltransferase (MTF) enzyme inhibitory activity. 3D models of the ligands and MTF were extracted ...  Read More
Photosensitizing properties for porphyrazine and some derivatives
Photosensitizing properties for porphyrazine and some derivatives

Amir Hossein Rasouli Amirabadi; Mahmoud Mirzaei

Volume 1, Issue 2 , March and April 2019, , Pages 223-227

Abstract
  Time-dependent density functional theory (TD-DFT) calculations were performed to study photosensitizing properties for porphrazine and eleven of its related derivatives. Two model categories ...  Read More