Showing 1 - 20 results of 25 for search '"Molecular dynamics"', query time: 0.04s Refine Results
  1. 1
    Molecular Dynamics Studies Of The Annealing Of Carbon Peapods
    by Lee, Thong Yan
    Published 2018
    “... molecules in each peapod. Classical molecular dynamics (MD) simulations are performed to study...”
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  2. 2
    Molecular Dynamics Simulation Of Thermal Processes For Selected Nano-Structures
    by Min, Tjun Kit
    Published 2018
    “...The core premise of this thesis is the adoption of molecular dynamics (MD) in simulating...”
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  3. 3
    Molecular Dynamics Simulation Of Translational And Rotational Diffusion Of Liquid Isoquinoline
    by Ahmad, Norariza
    Published 2010
    “...Molecular dynamics (MD) simulations of isoquinoline in liquid phase were performed at several...”
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  4. 4
    Molecular Dynamics Studies Of The Effects Of Neuraminidase Mutation On Oseltamivir Resistance
    by Muhammad Yusuf, Muhammad Yusuf
    Published 2015
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  5. 5
    Docking And Molecular Dynamics Simulation Studies Of Insulin-Β-Cyclodextrin Interactions
    by Muhammad, Erma Fatiha
    Published 2016
    “... of insulin-cyclodextrin complex for new oral insulin formulation. Docking and molecular dynamics simulations...”
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  6. 6
    Molecular Dynamics Simulation Of Polyhydroxyalkanoate Synthase From Chromobacterium Sp. Usm2
    by Annamalai, Nithyanan
    Published 2019
    “... of the PhaCCs protein. In this research study, molecular dynamics simulation approach has been utilized...”
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  7. 7
    Molecular Dynamics Simulation Of Pdms Nanostructure Distortion In Soft Lithography Demolding Process
    by Manap, Abdul Haadi Abdul
    Published 2021
    “.... In this thesis, the molecular dynamics simulation method was utilized to fill the gap to breach the fundamental...”
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  8. 8
    Study of Strontium Titanate and Barium Zirconate Properties Using Molecular Dynamics Simulation
    by Goh, Wen Fong
    Published 2013
    “...Molecular dynamics simulation has been carried out on strontium titanate and barium zirconate...”
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  9. 9
    Energetics, Thermal And Structural Properties Of Hafnium Clusters Via Molecular Dynamics Simulation
    by Ng , Wei Chun
    Published 2016
    “... (of sizes 2 < n < 99) are studied via molecular dynamics (MD) simulation. The interaction between...”
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  10. 10
    Molecular Docking And Molecular Dynamics Of 3-O-Octanoylcatechin Interactions Against Aldose Reductase
    by Soib’, Shikin Faezah
    Published 2019
    “... catechin derivatives using computational methods. Molecular docking, molecular dynamics (MD) simulation...”
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  11. 11
    Thermal Properties And Ground-State Structures Of Pure And Alloy Nanoclusters Via Molecular Dynamics Simulation
    by Ong, Yee Pin
    Published 2018
    “...The study of thermal properties of nanoclusters via molecular dynamics simulation is a common...”
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  12. 12
    Molecular Dynamics Studies: The Interaction Of Erythromycin A With A Single Base Substitution Of 50s Ribosomal Subunit
    by Mohamad Zobir, Siti Zuraidah
    Published 2012
    “... in the binding of macrolides. Molecular dynamics (MD) simulation is a great tool that was used in this study...”
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  13. 13
    In Silico Design And Constant-Ph Molecular Dynamics Study Of Human Igg1 Fc At Ph6.0 And Ph 7.5
    by Lim, Yee Ying
    Published 2020
    “... is related to the pH-dependent binding mechanism of IgG1 with FcRn. In this work, constant pH molecular...”
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  14. 14
    Molecular Mechanics Simulations Of Quartz Etching Process
    by Abdul Manap, Abdul Haadi
    Published 2016
    “... such as Monte Carlo (MC) method and Molecular Dynamics (MD) method enables researchers in building the model...”
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  15. 15
    Elucidating conserved sub-units from beta-coronavirus species for the creation of novel, cross-clade, and stable chimera sars-cov-2 spike proteins as future proof vaccine candidates
    by Susu, Wang
    Published 2023
    “... S proteins were investigated using bioinformatics techniques, structural predictions and molecular dynamics...”
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  16. 16
    Molecular Mechanics Simulations Of Quartz Etching Process
    by Manap, Abdul Haadi Abdul
    Published 2016
    “... (MC) method and Molecular Dynamics (MD) method enables researchers in building the model from ground...”
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  17. 17
    Host-Guest Interactions Between Betacyclodextrin And Selected Fluoroquinolones: A Molecular Modelling Study
    by Mousa Al-Wahsh, Saleh Ahmad
    Published 2016
    “... docking and molecular dynamics. The penetration of FQ molecules into the β-CD cavity take place via two...”
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  18. 18
    Combined Knowledge And Physics Based Approaches Towards Predicting Protein Structures
    “...-based molecular dynamics simulation methods. The core region of the protein wasinitially constructed via...”
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  19. 19
    Identification Of Potential Neuraminidase Inhibitors Using Ensemble-Based Virtual Screening
    by Lim, Kok Keong
    Published 2013
    “.... Variation of neuraminidase conformations from Protein Data Bank (PDB) and molecular dynamics (MD) simulation...”
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  20. 20
    Discovery Of New Targeting Agents Against Gapdh Receptor: In Silico And In Vitro Studies
    by Noh, Muhammad Amirul Asyraf
    Published 2023
    “... sent to undergo molecular dynamics (MD) simulations with GAPDH using GROMACS 2021.2 alongside NAD...”
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