Optimal molecular design under property prediction uncertainty. Maranas, C. D AIChE Journal, 43(5):1250–1264, Wiley Online Library, 1997.
bibtex   
@article{maranas1997optimal,
  title={Optimal molecular design under property prediction uncertainty},
  author={Maranas, Costas D},
  journal={AIChE Journal},
  volume={43},
  number={5},
  pages={1250--1264},
  year={1997},
  publisher={Wiley Online Library}
}

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