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      • Paolo Tosco

      3 results in Paolo Tosco in Authors: Paolo Tosco

      Category: Theoretical and Computational Chemistry
      ,
      Working Paper
      , Title:

      Identification and Analysis of Activity Cliffs Using 3D Similarity Techniques

      , Authors: Mark Mackey, Timothy J. Cheeseright, Paolo Tosco
      139
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      Category: Theoretical and Computational Chemistry
      ,
      Working Paper
      , Title:

      A Hybrid Alchemical Free Energy and Machine Learning Methodology for the Calculation of Absolute Hydration Free Energies of Small Molecules

      , Authors: Jenke Scheen, Wilson Wu, Antonia S. J. S. Mey, Paolo Tosco, Mark Mackey, Julien Michel
      156
      Downloads
      1
      Citations
      Category: Theoretical and Computational Chemistry
      ,
      Working Paper
      , Title:

      Automated Assessment of Binding Affinity via Alchemical Free Energy Calculations

      , Authors: Maximilian Kuhn, Stuart Firth-Clark, Paolo Tosco, Antonia S. J. S. Mey, Mark Mackey, Julien Michel
      395
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