Text-based representations with interpretable machine learning reveal structure-property relationships of polybenzenoid hydrocarbons

Fite, S; Wahab, A; Paenurk, E; Gross, Z; Gershoni-Poranne, R

Gershoni-Poranne, R (通讯作者),Technion Israel Inst Technol, Schulich Fac Chem, IL-32000 Haifa, Israel.

JOURNAL OF PHYSICAL ORGANIC CHEMISTRY, 2023; 36 (1):

Abstract

New tools are developed and applied to enable the use of interpretable machine learning for investigation of structure-property relationships in polyb......

Full Text Link