List of Articles Molecular dynamics simulation Open Access Article Abstract Page Full-Text 1 - 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 Abstract Page Full-Text 2 - Molecular dynamics simulation of interaction of Melittin and DMPC bilayer: Temperature dependence F. Kaveh H. Pasdar Open Access Article Abstract Page Full-Text 3 - 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 Abstract Page Full-Text 4 - Modifications of Internal Molecular Structures of Asphalt Components Due to Physical Aging Iffat R. Arisa Open Access Article Abstract Page Full-Text 5 - 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 6 - A DFT and Molecular Dynamics Study on Inhibitory Action of Three Amine Derivatives on Corrosion of Carbon Steel Mohammad Hossein Ghorbani Maryam Dehdab Open Access Article Abstract Page Full-Text 7 - Temperature Effect on Mechanical Properties of Top Neck Mollusk Shells Nano-Composite by Molecular Dynamics Simulations and Nano-Indentation Experiments A Nouroozi Masir A Darvizeh A Zajkani 10.22034/jsm.2019.668662 Open Access Article Abstract Page Full-Text 8 - Influences of Small-Scale Effect and Boundary Conditions on the Free Vibration of Nano-Plates: A Molecular Dynamics Simulation S.F Asbaghian Namin R Pilafkan Open Access Article Abstract Page Full-Text 9 - Molecular dynamics simulation study on the drug discovery in covid-19 disease Pejman Shir Ali Poor Elham Tazikeh-Lemeski Open Access Article Abstract Page Full-Text 10 - Investigation the effect of diameter and temperature on mechanical properties of single-walled boron nitride nanotubes by molecular dynamics simulation Mohammad reza Mostafaei Abdolhosein Fereidoon Masoud Darvish ganji Open Access Article Abstract Page Full-Text 11 - Atomistic simulations on the influence of diameter, number of walls, interlayer distance and temperature on the mechanical properties of MWBNNTs mohammad reza mostafaei Abdolhosein Fereidoon Masoud Darvish ganji Open Access Article Abstract Page Full-Text 12 - Molecular dynamic simulation for investigation of temperature, neck length and sheet size influence on mechanical properties of graphene nanobud marjan khorasani Abdolhosein Fereidon Open Access Article Abstract Page Full-Text 13 - 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 14 - 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 15 - Simulation of Fabrication toward High Quality Thin Films for Robotic Applications by Ionized Cluster Beam Deposition Esmaeil Zaminpayma Open Access Article Abstract Page Full-Text 16 - Molecular Dynamics Investigation of The Elastic Constants and Moduli of Single Walled Carbon Nanotubes Mohammad Mahdi Zaeri Saeed Ziaei-Rad 10.22034/jna.2017.01.008 Open Access Article Abstract Page Full-Text 17 - Effects of Colliding Particle Size and Velocity on Mechanical Properties of AZ31 after Surface Mechanical Attrition Treatment: Molecular Dynamics Simulation Ali Kazemi Ali Heidari Kamran Amini Farshid Aghadavoudi Mohsen Loh-Mousavi Open Access Article Abstract Page Full-Text 18 - 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 19 - 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 20 - Investigating the effect of particle size on Volume-per-atom parameter of TiO2 nanoparticles علی Mashreghi
