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Analysis of permeation events in molecular dynamics simulations with lipid bilayer membrane

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  • معلومة اضافية
    • الموضوع:
      2021
    • Collection:
      Smithsonian Institution: Digital Repository
    • نبذة مختصرة :
      Analysis scripts which compute and plot the time evolution of the number of water permeation events from Molecular Dynamics trajectories of a lipid bilayer membrane with waterchannels embedded. Details about molecule ID, duration time, time coordinate and direction of translocation events are collected in CSV format. Reference and trajectory files are provided for testing.
    • Relation:
      https://figshare.com/articles/software/Analysis_of_permeation_events_in_molecular_dynamics_simulations_with_lipid_bilayer_membrane/14588315
    • الرقم المعرف:
      10.5281/zenodo.4751683
    • Rights:
      CC BY 4.0
    • الرقم المعرف:
      edsbas.96612F5F
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