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TODO.md

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TODO list for the future

  • Complete sk_lebedev.py module
  • add sk.py module to compute static structural factor using Debye scattering formula
  • Concatenate function. Able to append series of H5MD file into one file.
  • add fourth order dynamic susceptibility compute module
    • add it
    • test it
  • add contact map compute module
    • add it
    • test it
  • write information on LammpsData in README file
  • add function to calculate the gyration tensor of each loop region