Characterisation of the molecular mechanism of permeation of the prodrug me-5ala across the human stratum corneum using molecular_dynamics_simulations curtin medical curtin health innovation research and curtin for computation

HIGHLIGHTS

  • who: Publisher`s and colleagues from the Curtin University, G, Perth, WA, Australia have published the research: Characterisation of the Molecular Mechanism of Permeation of the Prodrug Me-5ALA across the Human Stratum Corneum Using Molecular_Dynamics_Simulations Curtin Medical Curtin Health Innovation Research and Curtin for Computation, in the Journal: (JOURNAL)
  • what: MD simulations predicted that Me-5ALA has a higher permeability than its parent compound 5ALA across a model lipid bilayer of the SC.

SUMMARY

    Characterisation of changes in free_energy and the prediction of partition, diffusion and permeation coefficients, as well . . .

     

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