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How the methodology of 3D structure preparation influences the quality of QSPR models?

Stanislav GeidlRoman BeránekRadka Svobodová VarekováTomás BouchalMiroslav BrumovskýMichal KuderaOndrej SkrehotaJaroslav Koca
Published in: J. Cheminformatics (2012)
Keyphrases
  • high quality
  • probabilistic model
  • genetic algorithm
  • quality measures
  • design methodology
  • database
  • real time
  • machine learning
  • hierarchical structure
  • mathematical models
  • trading systems