Work by Coley et al. features in the next Digital Discovery infographic, which introduces a reformulation of the roughness index (ROGI) to help understand the roughtness of QSPR surfaces created by new models.
Get the whole story in their article, available open access:
David E. Graff, Edward O. Pyzer-Knapp, Kirk E. Jordan, Eugene I. Shakhnovich and Connor W. Coley, Digital Discovery, 2023, 2, 1452–1460