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chitin_builder's Issues

JOSS Review

Hi @jfaraudo, I've started my review and will file issues here. I'm working on the review now so I'm going to edit this comment as I go.

The following review checklist items require changes:

  • License: Does the repository contain a plain-text LICENSE file with the contents of an OSI approved software license?
    • Requested Change: Please use the uppercase LICENSE for the license file's name
  • Paper: The paper has far too much content at this point and should be shortened considerably. Please review https://joss.readthedocs.io/en/latest/submitting.html#what-should-my-paper-contain. I think you could reduce your Introduction and Statement of Need section into just a Statement of Need section into three paragraphs, mostly containing the text at the end of the existing section. Remove Methods, Program description, use and features, Examples, Compatibility and distribution.

Non-review-checklist items:

  • Update Zenodo citation to match auto-generated citation
  • Try to use the name "Chitin Builder" everywhere, updating any alternative usages
  • Had an issue opening the documentation from the Chitin Builder GUI. Filed #4.

Cannot find BGNA residue for chitin

Hi,
In ForceField directory, the readme says "File with CHARMM36 carbohydrate force field parameters including chitin as BGNA residue." However, I cannot find the corresponding topology file with residue name BGNA.

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