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Research

Results for Molecular dynamics simulation

Publications & Outputs

  1. Interaction of gentamicin and gentamicin-AOT with poly-(lactide-co-glycolate) in a drug delivery system - density functional theory calculations and molecular dynamics simulation

    Duran, S., Anwar, J. & Moin, S. T., 31/03/2023, In: Biophysical chemistry. 294, 11 p., 106958.

    Research output: Contribution to Journal/Magazine › Journal article › peer-review

  2. Carrot-based covalently bonded saccharides as a new 2D material for healing defective calcium-silicate-hydrate in cement: Integrating atomistic computational simulation with experimental studies

    Chi, Y., Huang, B., Saafi, M., Ye, J. & Lambert, C., 15/10/2020, In: Composites Part B: Engineering. 199, 15 p., 108235.

    Research output: Contribution to Journal/Magazine › Journal article › peer-review

  3. Polymorphic Phase Transitions: Macroscopic Theory and Molecular Simulation

    Anwar, J. & Zahn, D., 2017, In: Advanced Drug Delivery Reviews. 117, p. 47-70 24 p.

    Research output: Contribution to Journal/Magazine › Journal article › peer-review

  4. Breaching the skin barrier - Insights from molecular simulation of model membranes

    Notman, R. & Anwar, J., 02/2013, In: Advanced Drug Delivery Reviews. 65, 2, p. 237-250 14 p.

    Research output: Contribution to Journal/Magazine › Journal article › peer-review