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Benefits of statistical molecular design, covariance analysis, and reference models in QSAR: a case study on acetylcholinesterase.

C. David AnderssonJ. Mikael HillgrenCecilia M. LindgrenWeixing QianChristine AkfurLotta BergFredrik EkströmAnna Linusson
Published in: J. Comput. Aided Mol. Des. (2015)
Keyphrases
  • case study
  • design process
  • drug discovery
  • reference models
  • reference model
  • artificial intelligence
  • databases
  • decision makers
  • database
  • open source
  • domain specific
  • anomaly detection
  • data integration