Showing 1 - 10 results of 10 for search '"Molecular dynamics"', query time: 0.03s Refine Results
  1. 1
    Molecular docking and molecular dynamics simulation of mutant carboxylesterase in enhancing microplastics binding affinity
    by Lameh, Fatana
    Published 2021
    “... to molecular dynamics (MD) simulation using GROMACS to gauge the binding quality of the above-said proteins PET...”
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  2. 2
    Molecular dynamics simulations on structural differences of glucose-6-phosphate dehydrogenase deficiency variants among the Asian population
    “..., L128P, R459L, V431M, H32R, G163S, and G131V) were chosen for analysis using molecular dynamics...”
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  3. 3
    Molecular dynamics simulation of guest diffusional and conformational behaviour of hexadecane-1,16-diol and hexadecane in urea inclusion compound models
    by Mustafa, Siti Fatimah Zaharah
    Published 2018
    “... properties was obtained using molecular dynamics simulation approach. Three-stage of model systems have been...”
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  4. 4
    Antioxidant and antidiabetic activities of proteins from Moringa oleifera
    by Zulkifli, Zetty Amirah
    Published 2021
    “... in the petiole. In silico analysis of TKT indicated it to be a thermostable protein upon molecular dynamics (MD...”
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  5. 5
    In silico modelling and molecular interaction of elongation factor receptor with pathogenic elongation factor tu 18
    by Gunasekaran, Shivaranjini
    Published 2019
    “... by homology modelling using HHpred Modeller, followed by docking and molecular dynamics (MD) simulation of EFR...”
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  6. 6
    In silico site-directed mutagenesis of Acinetobacter Haemolyticus Lipase KV1 for improved alkaline stability
    “... pHs (pH 8.0 −10.0). Molecular dynamics (MD) simulation of Lip-KV1 and Mut-LipKV1 protein models under...”
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  7. 7
    In silico analysis on degradation order of cellulosic components in oil palm leaves by Trichoderma asperellum UC1 enzymes
    by Bahaman, Aina Hazimah
    Published 2020
    “... of molecular docking, molecular dynamics (MD) simulation and molecular mechanics Poisson-Boltzmann surface area...”
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  8. 8
    Computational analysis on protein-ligand interaction of xylitol-phosphate dehydrogenase enzymes for xylitol production
    by Razali, Siti Aisyah
    Published 2018
    “... the key amino acids involved in the substrate binding. In silico modelling, comparative molecular dynamic...”
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  9. 9
    Antioxidant activity and antioxidant proteins dynamic simulation of Malaysia upland rice genotypes
    by Kamdi, Nurul Hafifi
    Published 2018
    “... proteins chosen from an earlier upland rice seed profiling data. The molecular dynamic (MD) simulation...”
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  10. 10
    Crosslinking immobilisation of surface-engineered xylanase and its hydrolysis performance of oil palm empty fruit bunches for xylooligosaccharide production
    “... on the surface of the enzyme (mXyn) and docked with glutaraldehyde using AutoDock. Molecular Dynamic (MD...”
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