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    • Dominik Tichy's avatar
      Partial atomic charges extension (#808) · 6db96001
      Dominik Tichy authored
      * feat: partial charges extension
      
      * chore: pullrequest actions
      
      * feat: example
      
      * fix: review changes
      
      * fix: updated example structure categories
      
      * fix(changelog): shorter description
      
      * fix: code review changes
      
      * fix: cosmetic changes
      6db96001
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