@misc{indiciae06c8cfa853d6, title = {Pairwise Difference Regression: A Machine Learning Meta-algorithm for Improved Prediction and Uncertainty Quantification in Chemical Search}, author = {Tynes, Michael and Gao, Wenhao and Burrill, Daniel J. and Batista, Enrique R. and Perez, Danny and Yang, Ping and Lubbers, Nicholas}, year = {2021}, doi = {10.1021/acs.jcim.1c00670}, url = {https://www.osti.gov/biblio/1811954}, note = {Source identifier: 1811954} }