Predicting partition coefficients for the SAMPL7 physical property challenge using the ClassicalGSG method. - Nazanin Donyapour; Alex Dickson (J. Comput. Aided Mol. Des., 2021)

ClassicalGSG: Prediction of logP using classical molecular force fields and geometric scattering for graphs. - Nazanin Donyapour; Matthew J. Hirn; Alex Dickson (J. Comput. Chem., 2021)