Lior Hirschfeld, Kyle Swanson, Kevin Yang, Regina Barzilay, Connor W. Coley. Uncertainty Quantification Using Neural Networks for Molecular Property Prediction. Journal of Chemical Information and Computer Sciences, 60(8):3770-3780, 2020. [doi]
@article{HirschfeldSYBC20, title = {Uncertainty Quantification Using Neural Networks for Molecular Property Prediction}, author = {Lior Hirschfeld and Kyle Swanson and Kevin Yang and Regina Barzilay and Connor W. Coley}, year = {2020}, doi = {10.1021/acs.jcim.0c00502}, url = {https://doi.org/10.1021/acs.jcim.0c00502}, researchr = {https://researchr.org/publication/HirschfeldSYBC20}, cites = {0}, citedby = {0}, journal = {Journal of Chemical Information and Computer Sciences}, volume = {60}, number = {8}, pages = {3770-3780}, }