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refactor library organization #4

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fgrunewald opened this issue Apr 5, 2020 · 0 comments · Fixed by #29
Closed

refactor library organization #4

fgrunewald opened this issue Apr 5, 2020 · 0 comments · Fixed by #29
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@fgrunewald
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enhancement New feature or request
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prepare for first release

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@fgrunewald
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Come up with some organization of the library to merge vermouth force-field with polyply input in a sensible fashion. Things to think about:

  • import rtps from gromacs libraries if GMXRC is sourced
  • organize by AA, CG or rather ff-files polyply etc.
  • add some form of licenses and citations to these files
@fgrunewald fgrunewald added the enhancement New feature or request label Apr 5, 2020
@fgrunewald fgrunewald added this to To do in prepare for first release via automation Apr 5, 2020
@fgrunewald fgrunewald mentioned this issue Apr 5, 2020
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@fgrunewald fgrunewald moved this from To do to In progress in prepare for first release Apr 7, 2020
@fgrunewald fgrunewald self-assigned this Apr 7, 2020
@fgrunewald fgrunewald mentioned this issue Apr 9, 2020
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@fgrunewald fgrunewald moved this from In progress to To do in prepare for first release Apr 16, 2020
@fgrunewald fgrunewald moved this from To do to In progress in prepare for first release Apr 22, 2020
@fgrunewald fgrunewald moved this from In progress to Review in progress in prepare for first release Apr 22, 2020
@fgrunewald fgrunewald moved this from Review in progress to In progress in prepare for first release May 20, 2020
@fgrunewald fgrunewald moved this from In progress to Review in progress in prepare for first release Jun 1, 2020
@fgrunewald fgrunewald linked a pull request Jun 1, 2020 that will close this issue
[2] Coord gen new #29
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prepare for first release automation moved this from Review in progress to Done Jun 8, 2020
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[2] Coord gen new marrink-lab/polyply_1.0
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@fgrunewald