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Rigorous Deduction Theory for Assignment of Multidimensional NMR Spectra Using the Independent Spin Coupling Network Approach.

Jun XuPhilip N. Borer
Published in: J. Chem. Inf. Comput. Sci. (1994)
Keyphrases
  • nmr spectra
  • multi dimensional
  • network structure
  • complex networks
  • feature extraction
  • shortest path
  • benchmark datasets
  • social network analysis
  • random forest