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Systematic Comparison of Experimental Crystallographic Geometries and Gas-Phase Computed Conformers for Torsion Preferences.

Dakota L. FolmsbeeDavid Ryan KoesGeoffrey R. Hutchison
Published in: J. Chem. Inf. Model. (2023)
Keyphrases
  • genetic algorithm
  • neural network
  • artificial intelligence
  • database systems
  • information retrieval
  • learning algorithm
  • preprocessing
  • qualitative and quantitative
  • planar curves