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Learn molecules

Project for the "Computational Mathematics" course, University of Bologna (2020/2021)

Developers

Usage

In this folder you can find 4 files/directories:

  • MoleculesTutorial.nb
    • This is what the user should run if he/she wants to start the tutorial
  • PreProcessing.nb
    • Extra functions already run by us to generete some files you can find on the Resources folder
  • pyrofile.m
    • Package file that contains auxiliary functions
  • Resources
    • Folder containing useful files for the notebook

Learning

Learning part

Self-assessment

Self-assessment part