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      • Richard B. Canty

      2 results in Richard B. Canty in Authors: Richard B. Canty

      Category: Chemical Engineering and Industrial Chemistry
      ,
      Working Paper
      , Title:

      Autonomous, multi-property-driven molecular discovery: from predictions to measurements and back

      , Authors: Brent Koscher, Richard B. Canty, Matthew A. McDonald, Kevin P. Greenman, Charles J. McGill, Camille L. Bilodeau, Wengong Jin, Haoyang Wu, Florence H. Vermeire, Brooke Jin, Travis Hart, Timothy Kulesza, Shih-Cheng Li, Tommi S. Jaakkola, Regina Barzilay, Rafael Gómez-Bombarelli, William H. Green, Klavs F Jensen
      Version 1 posted 13 April 2023
      2,829
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      7
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      Category: Chemical Engineering and Industrial Chemistry
      ,
      Working Paper
      , Title:

      General Chemically Intuitive Atom- and Bond-level DFT Descriptors for Machine Learning Approaches to Reaction Condition Prediction

      , Authors: Miguel Nouman, Richard B. Canty, Brent A. Koscher, Matthew A. McDonald, Klavs F Jensen
      Version 1 posted 02 December 2024
      602
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