# Chemistry-informed macromolecule graph representation for similarity computation, unsupervised and supervised learning

> Research article (Machine Learning Science and Technology, 2022) · cited 45× · AI/ML

**Wikidata**: [openalex:W4211041253](https://www.wikidata.org/wiki/openalex:W4211041253)  
**Source**: https://4ort.xyz/entity/chemistry-informed-macromolecule-graph-representation-for-similarity-computation-unsupervised-and-supervised-learning