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Open-ComBind Defaults, CLI, and Documentation #37

Merged
merged 18 commits into from
Nov 7, 2023
Merged

Open-ComBind Defaults, CLI, and Documentation #37

merged 18 commits into from
Nov 7, 2023

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drewnutt
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@drewnutt drewnutt commented Nov 7, 2023 •
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Description

  • Fixed issues with the RTD pipeline so that documentation builds successfully.
  • Fixed issues with code documentation for accuracy and readability.
  • Minor bugfix for parallel IFP computation
  • Added single ligand ligprep to the CLI for ease of use
  • CLI documentation help and cleanup

Status

  • Ready to go

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codecov bot commented Nov 7, 2023

Codecov Report

Merging #37 (eadfa22) into main (e40b0d3) will increase coverage by 0.03%.
Report is 1 commits behind head on main.
The diff coverage is 12.50%.

Additional details and impacted files

@drewnutt drewnutt merged commit 6655cd7 into main Nov 7, 2023
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@drewnutt drewnutt deleted the defaults-and-docs branch November 7, 2023 20:54
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