# Designing compact training sets for data-driven molecular property prediction through optimal exploitation and exploration

> Research article (Molecular Systems Design & Engineering, 2019) · cited 21× · AI/ML

**Wikidata**: [openalex:W2970808434](https://www.wikidata.org/wiki/openalex:W2970808434)  
**Source**: https://4ort.xyz/entity/designing-compact-training-sets-for-data-driven-molecular-property-prediction-through-optimal-exploitation-and-explorati