Conserved Water Networks Identification for Drug Design Using Density Clustering Approaches on Positional and Orientational Data. - Jelena Tosovic; Domagoj Fijan; Marko Jukic; Urban Bren (J. Chem. Inf. Model., 2022)

Change point detection of events in molecular simulations using dupin. - Brandon L. Butler; Domagoj Fijan; Sharon C. Glotzer (Comput. Phys. Commun., 2024)