# Overcoming the Heuristic Nature of <i>k</i>-Means Clustering: Identification and Characterization of Binding Modes from Simulations of Molecular Recognition Complexes

> Research article (Journal of Chemical Information and Modeling, 2020) · cited 20× · AI/ML

**Wikidata**: [openalex:W3021303688](https://www.wikidata.org/wiki/openalex:W3021303688)  
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