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Provide complete examples and tutorials  #11

@jaimergp

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@jaimergp

README.md and examples/ are not enough. We should add complete tutorials and proper documentation, as suggested by @ajasja in #9. This would be probably tackled when I start writing the manuscript for OMMProtocol, around February.

In the meantime, we can chat here and provide different systems and sources. For example, some tutorials could include:

OMMProtocol

  • Absolute beginner: prepared PDB file compatible with standard forcefield.
  • Intermediate: prepare dirty PDB with PDBFixer.
  • Advanced: use ambertools to prepare Prmtop/Inpcrd and then come back to ommprotocol.

OMMAnalyze

  • Just to showcase how to obtain quick plots using the output files from OMMProtocol.

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