TY - RPRT TI - Dimensionally reduced machine learning model for predicting single component octanol–water partition coefficients AU - Kenney, David H. AU - Paffenroth, Randy C. AU - Timko, Michael T. AU - Teixeira, Andrew R. PY - 2023 DO - 10.1186/s13321-022-00660-1 UR - https://www.osti.gov/biblio/1909929 ID - 1909929 ER -