# Limitations of machine learning models when predicting compounds with completely new chemistries: possible improvements applied to the discovery of new non-fullerene acceptors

> Research article (Digital Discovery, 2022) · cited 35× · AI/ML

**Wikidata**: [openalex:W4220715560](https://www.wikidata.org/wiki/openalex:W4220715560)  
**Source**: https://4ort.xyz/entity/limitations-of-machine-learning-models-when-predicting-compounds-with-completely-new-chemistries-possible-improvements-a
