8000 Comparing v3.1.0...v3.2.0 · ur-whitelab/exmol · GitHub
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base reposi 8000 tory: ur-whitelab/exmol
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base: v3.1.0
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head repository: ur-whitelab/exmol
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compare: v3.2.0
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  • 2 commits
  • 11 files changed
  • 2 contributors

Commits on Mar 7, 2025

  1. papers fix (#148)

    * paper 1 fix -- updated imports & invalid features
    
    * clear execution history
    
    * tried again.. should work this time
    
    * updated mordred to use mordredcommunity
    
    * fixed paper2 bug with keras
    
    * fixed rdkit error
    
    * better fix for rdkit error
    
    * test url requests
    
    * test url requests part 2
    
    * revert "test url requests part 2"
    
    This reverts commit 184424e.
    
    * revert "test url requests"
    
    This reverts commit 1a3b439.
    qcampbel authored Mar 7, 2025
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Commits on Mar 8, 2025

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