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PyFrag 2019 - Automating the exploration and analysis of reaction mechanisms.

Xiaobo SunThomas M. SoiniJordi PoaterTrevor A. HamlinF. Matthias Bickelhaupt
Published in: J. Comput. Chem. (2019)
Keyphrases
  • neural network
  • machine learning
  • information retrieval
  • data analysis
  • image analysis
  • real time
  • case study
  • database systems
  • multiscale
  • cooperative
  • pattern recognition
  • active learning
  • automatic analysis