TY - RPRT TI - Graph-Based Approaches for Predicting Solvation Energy in Multiple Solvents: Open Datasets and Machine Learning Models AU - Ward, Logan AU - Dandu, Naveen AU - Blaiszik, Ben AU - Narayanan, Badri AU - Assary, Rajeev S. AU - Redfern, Paul C. AU - Foster, Ian AU - Curtiss, Larry A. PY - 2021 DO - 10.1021/acs.jpca.1c01960 UR - https://www.osti.gov/biblio/1854527 ID - 1854527 ER -