# Machine learning combines atomistic simulations to predict SARS-CoV-2 Mpro inhibitors from natural compounds

> Research article (Molecular Diversity, 2023) · cited 17× · AI/ML

**Wikidata**: [openalex:W4321605341](https://www.wikidata.org/wiki/openalex:W4321605341)  
**Source**: https://4ort.xyz/entity/machine-learning-combines-atomistic-simulations-to-predict-sars-cov-2-mpro-inhibitors-from-natural-compounds