List of Articles دینامیک مولکولی Open Access Article Abstract Page Full-Text 1 - شبیه سازی برهمکنش آنزیم انتگراز HIV-I با مهارکنندههای آن به کمک روش دینامیک مولکولی محمد رضا دایر Open Access Article Abstract Page Full-Text 2 - QSAR studies, docking and molecular dynamics simulation of a number of heterocyclic compounds including nitrogen oxide as new anti-tuberculosis agents Ghasem Ghasemi Babak Motahary Robabe SayadikordAbadi Open Access Article Abstract Page Full-Text 3 - Simulation of the interaction of the enzyme Fumarate reductase with Nizatidine and comparison with the inhibitory effect some Yarrow compounds of the plant to enhance the effects of Metronidazole on Helicobacter pylori in Insilico khadijeh tavakoli hafshejani ali kazemi babahydari afsaneh nikkhah Open Access Article Abstract Page Full-Text 4 - Structural and molecular analysis of SARSCoV-2 spike protein following S494P point mutations using bioinformatics and molecular dynamics methods. Mehr Ali Mahmood Janlou Hasan Saheb jamii elham tazikeh lemeski Open Access Article Abstract Page Full-Text 5 - Identification of Lampyris turkestanicus luciferase Stabilizing Mutations Using Bioinformatics Software and Web Servers and Molecular Dynamics Simulation Alireza Khondabi hassan sahebjamee Fahimeh Baghbani-Arani Open Access Article Abstract Page Full-Text 6 - In silico study to Identify New Inhibitors of Staphylococcus aureus (S. aureus) Sortase A hassan sahebjamee Mehr Ali Mahmood Janlou Open Access Article Abstract Page Full-Text 7 - QSAR, Molecular docking and Molecular dynamics studies simulation of Epigenetic inhibitors ghasem ghasemi babak motahary Robabe SayadikordAbadi omid alizadeh Open Access Article Abstract Page Full-Text 8 - Analysis of Thermo-Mechanical Behavior of Gold Nanowire by Using Molecular Dynamics Method Mohammad Tahmasebipour Reihaneh Ahmadi Mehrzad Modarres Open Access Article Abstract Page Full-Text 9 - Investigation of the Effect of Atomic Structure Defects on the Thermal Expansion Coefficient of Zigzag and Armchair Carbon Nanotubes Using Molecular Dynamics Method Farshid Aghadavoudi Hossein Golestanian Open Access Article Abstract Page Full-Text 10 - Investigating the Effect of Poly (D L-Lactic Acid) Molecular Weight on the Shape Memory Parameters: A Molecular Dynamics Study Mohammad Amini Abbas Montazeri Open Access Article Abstract Page Full-Text 11 - تاثیر هندسه زبری دیواره نانوکانال در رفتار جریان پوازیه نانوسیال آب-مس محمد میثم امراللهی پورشیرازی داود طغرایی احمدرضا عظیمیان Open Access Article Abstract Page Full-Text 12 - Numerical investigation of wettability of copper substrates with graphene-like nanolayers Aref Pishevar Open Access Article Abstract Page Full-Text 13 - Studying mechanical behavior of non-wrinkled phosphorene nanotubes under uniaxial loading هومن Esfandyar A.R Setoodeh Open Access Article Abstract Page Full-Text 14 - Investigating the effect of particle size on Volume-per-atom parameter of TiO2 nanoparticles علی Mashreghi Open Access Article Abstract Page Full-Text 15 - تاثیر هندسه و سرعت ابزار بر تولید حرارت در فرایند برش نانومتری تکبلور مسی با استفاده از روش شبیهسازی دینامیک مولکولی سید وحید حسینی مهرداد وحدتی