Search Results - "MOLECULAR-DYNAMICS"

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  1. 1
    Thermal behavioral analysis of bacillus stearothermophilus L1 lipase at elevated temperature by molecular dynamics simulation method

    Thermal behavioral analysis of bacillus stearothermophilus L1 lipase at elevated temperature by molecular dynamics simulation method by Abdul Rahman, Mohd Basyaruddin, Abedikargiban, Roghayeh, Basri, Mahiran, Raja Abdul Rahman, Raja Noor Zaliha, Salleh, Abu Bakar

    Published 2007
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  2. 2
    Thermodynamic evaluation and molecular dynamic simulation of thermostable lipase from ; Bacillus stearothermophilus PI, Bacillus stearothermophilus LI and Geobacillus stearothermophilus Strain TI

    Thermodynamic evaluation and molecular dynamic simulation of thermostable lipase from ; Bacillus stearothermophilus PI, Bacillus stearothermophilus LI and Geobacillus stearothermop... by Abdul Rahman, Mohd Basyaruddin, Abedikargiban, Roghayeh, Basri, Mahiran, Raja Abdul Rahman, Raja Noor Zaliha, Salleh, Abu Bakar, Abdul Wahab, Habibah, Jacobs, Donald

    Published 2007
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  3. 3
    Molecular dynamics study of the structure, flexibility and dynamics of thermostable L1 lipase at high temperatures.

    Molecular dynamics study of the structure, flexibility and dynamics of thermostable L1 lipase at high temperatures. by Abedi Karjiban, Roghayeh, Abdul Rahman, Mohd Basyaruddin, Basri, Mahiran, Salleh, Abu Bakar, Jacobs, Donald, Abdul Wahab, Habibah

    Published 2009
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  4. 4
    Design and synthesis of new 1-alkyl-3-butylimidazolium bromide ionic liquids as media for DNA solvation

    Design and synthesis of new 1-alkyl-3-butylimidazolium bromide ionic liquids as media for DNA solvation by Jumbri, Khairulazhar

    Published 2015
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  5. 5
    Molecular dynamics simulations using graphics processing units

    Molecular dynamics simulations using graphics processing units by Baker, J.A., Hirst, J.D.

    Published 2011
    Subjects: “…Molecular dynamics…”
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  6. 6
    Effect of transition metal ion substitution on thermostable T1 lipase activity

    Effect of transition metal ion substitution on thermostable T1 lipase activity by Harun, Harmiza

    Published 2013
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  7. 7
    Structural elements of an NRPS cyclization domain and its intermodule docking domain

    Structural elements of an NRPS cyclization domain and its intermodule docking domain by Dowling, Daniel P., Kung, Yan, Croft, Anna K., Taghizadeh, Koli, Kelly, Wendy L., Walsh, Christopher T., Drennan, Catherine L.

    Published 2016
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  8. 8
    Molecular dynamics simulation of the phosphorylation-induced conformational changes of a tau peptide fragment

    Molecular dynamics simulation of the phosphorylation-induced conformational changes of a tau peptide fragment by Lyons, Albert, Gandhi, Neha, Mancera, Ricardo

    Published 2014
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  9. 9
    Computing infrared spectra of proteins using the exciton model

    Computing infrared spectra of proteins using the exciton model by Husseini, Fouad S., Robinson, David, Hunt, Neil T., Parker, Anthony W., Hirst, J.D.

    Published 2016
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  10. 10
    Surface Potential of MIBC at Air/Water Interface: a Molecular Dynamics Study

    Surface Potential of MIBC at Air/Water Interface: a Molecular Dynamics Study by Phan, Chi, Nakahara, H., Shibata, O., Moroi, Y., Nguyen, Van Cuong, Chaudhary, Deeptangshu

    Published 2012
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  11. 11
    Novel Structural Features of CDK Inhibition Revealed by an ab Initio Computational MethodCombined with Dynamic Simulations

    Novel Structural Features of CDK Inhibition Revealed by an ab Initio Computational MethodCombined with Dynamic Simulations by Heady, L., Fernandez-Serra, M., Mancera, Ricardo, Joyce, S., Venkitaraman, A., Artacho, E., Skylaris, C., Ciacchi, L., Payne, M.

    Published 2006
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  12. 12
    Unravelling the Shuttling Mechanism in a Photoswitchable Multicomponent Bistable Rotaxane

    Unravelling the Shuttling Mechanism in a Photoswitchable Multicomponent Bistable Rotaxane by Raiteri, Paolo, Bussi, G., Cucinotta, C., Credi, A., Stoddart, J., Parrinello, M.

    Published 2008
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  13. 13
    Molecular Dynamics Simulation of New Tetraethylammonium-Based Amino Acid Ionic Liquids

    Molecular Dynamics Simulation of New Tetraethylammonium-Based Amino Acid Ionic Liquids by Haron, Naimah

    Published 2011
    Subjects: “…Molecular dynamics - Computer simulation…”
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  14. 14
    Molecular docking and molecular dynamic simulation of 1,3-Benzoxazine derivatives against penicillin binding protein 2A of methicillin-resistant Staphlyococcus aureus

    Molecular docking and molecular dynamic simulation of 1,3-Benzoxazine derivatives against penicillin binding protein 2A of methicillin-resistant Staphlyococcus aureus by Alharbi, Nourah Jamaan H

    Published 2023
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  15. 15
    Computational studies of DNA structure and recognition

    Computational studies of DNA structure and recognition by Grindon, Christina Rebecca

    Published 2004
    Subjects: “…molecular dynamics…”
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  16. 16
    Molecular dynamics study of methane in water: diffusion and structure

    Molecular dynamics study of methane in water: diffusion and structure by Zhang, J., Piana, Stefano, Freij-Ayoub. R., Rivero, M., Choi, S.

    Published 2006
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  17. 17
    Pressure-induced unfolding of L1 lipase using molecular dynamics simulations and quantum mechanics calculations

    Pressure-induced unfolding of L1 lipase using molecular dynamics simulations and quantum mechanics calculations by Lim, Wui Zhuan

    Published 2016
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  18. 18
    Computational study of the structure and electronic circular dichroism spectroscopy of blue copper proteins

    Computational study of the structure and electronic circular dichroism spectroscopy of blue copper proteins by Do, Hainam, Deeth, Robert J., Besley, Nicholas A.

    Published 2013
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  19. 19
    NMR Studies of Nucleic Acids as Drug Targets

    NMR Studies of Nucleic Acids as Drug Targets by Gallagher, Cathal T

    Published 2004
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  20. 20
    Computational and experimental studies on the formation of polymer-drug nanoparticles

    Computational and experimental studies on the formation of polymer-drug nanoparticles by Styliari, Ioanna Danai

    Published 2017
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