Category:
Theoretical and Computational Chemistry
,
Working Paper
, Title:
Graph-Based Approaches for Predicting Solvation Energy in Multiple Solvents: Open Datasets and Machine Learning Models
, Authors:
Logan Ward, Naveen Dandu, Ben Blaiszik, Badri Narayanan, Rajeev S. Assary, Paul C. Redfern, Ian Foster, Larry A. Curtiss
Version 1 posted 01 July 2021
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