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Fundamental and Computational Sciences Directorate

Staff information

Garrett Goh

High Performance Computing
Pauling Fellow
Pacific Northwest National Laboratory
PO Box 999
MSIN: J4-30
Richland, WA 99352

PNNL Publications

2017

  • Goh GB, CM Siegel, A Vishnu, and NO Hodas. 2017. "ChemNet: A Transferable and Generalizable Deep Neural Network for Small-Molecule Property Prediction." In Machine Learning for Molecules and Materials (NIPS 2017 Workshop), December 8, 2017, Long Beach, California.  Neural Information Processing Systems Foundation, Inc., LA JOLLA, CA. 
  • Goh GB, NO Hodas, and A Vishnu. 2017. "Deep Learning for Computational Chemistry." Journal of Computational Chemistry 38(16):1291-1307.  doi:10.1002/jcc.24764

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