# Chemical Space Exploration with Active Learning and Alchemical Free Energies

> Research article (Journal of Chemical Theory and Computation, 2022) · cited 89× · AI/ML

**Wikidata**: [openalex:W4296794490](https://www.wikidata.org/wiki/openalex:W4296794490)  
**Source**: https://4ort.xyz/entity/chemical-space-exploration-with-active-learning-and-alchemical-free-energies