List of Articles Simulation

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  1 - Physicochemical properties analysis and dopamine D2 receptor (D2R) docking of zotepine as an atypical antipsychotic antagonist
  Mehdi Nabati Vida Bodaghi-Namileh
• Open Access Article
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  2 - Evaluation of [18F]FPTT Molecular structure and its binding to progesterone receptor (PR) for PET scan of breast cancer FPTT Molecular structure and its binding to progesterone receptor (PR) for PET scan of breast cancer
  Mehdi Nabati Vida Bodaghi-Namileh Mohammad Mazidi
• Open Access Article
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  3 - 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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  4 - Sensing of Methanol and Ethanol with Nano-Structured SnO2 (110) in Gas Phase: Monte Carlo Simulation
  N. Mangkorntong L. Mahdavian F. Mollaamin M. Monajjemi
• Open Access Article
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  5 - Investigation of Ethanol Effect on Albumin Active Site by Simulation Methods and Calculation of its Heat Capacity
  N. Dalili Mansour K. Zare G. Ghasemi
• Open Access Article
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  6 - Molecular dynamics simulation of interaction of Melittin and DMPC bilayer: Temperature dependence
  F. Kaveh H. Pasdar
• Open Access Article
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  7 - Investigation of Monte Carlo, Molecular Dynamic and Langevin dynamic simulation methods for Albumin- Methanol system and Albumin-Water system
  M. Monajjemi N. Dalili Mansour A. Kazemi Babaheydari M. Khaleghian
• Open Access Article
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  8 - Theoretical Study of Drug Delivery Ability of Carbon INanotube
  N. Dalill Mansour K. Zare A Elsagh
• Open Access Article
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  9 - Gyration Radius and Energy Study at Different Temperatures for Acetylcholine Receptor Protein in Gas Phase by Monte Carlo, Molecular and Langevin Dynamics Simulations
  M. Monajjemi A. R. Oliaey
• Open Access Article
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  10 - Energy study at different solvents for potassium Channel Protein by Monte Carlo, Molecular and Langevin Dynamics Simulations
  F. Mollaamin T. Nejadsattari I. Layali
• Open Access Article
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  11 - Physical adsorption between mono and diatomic gases inside of Carbon nanotube with respect to potential energy
  B. Esfandiari M. Monajjemi
• Open Access Article
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  12 - Characterization of Carbon Nanotube (CNT) in Adsorption Gas: Monte Carlo and Langevin Dynamic Simulation
  L. Mahdavian M. Monajjemi R. Zhiani
• Open Access Article
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  13 - Molecular Modeling Studies on Vinblastine Binding Site of Tubulin for Antimitotic agents
  Z. Varmaghani F. Mollaamin L. Pishkar B. Khalili Hadda
• Open Access Article
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  14 - Introducing critical residues in the human prion protein and its Asp 178 Asn mutant by molecular dynamics simulation
  S. Mansouri
• Open Access Article
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  15 - Molecular docking and in silico ADME prediction of Ticagrelor as an antagonist of the P2Y12 receptor
  
• Open Access Article
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  16 - Interaction of Pyrimidine Nucleobases with Silicon Carbide Nanotube: Effect of Functionalization on Stability and Solvation
  S. Ketabi S. M. Hashemianzadeh
• Open Access Article
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  17 - Modifications of Internal Molecular Structures of Asphalt Components Due to Physical Aging
  Iffat R. Arisa