"GESim: ultrafast graph-based molecular similarity calculation via von ..."

Hiroaki Shiokawa, Shoichi Ishida, Kei Terayama (2025)

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DOI: 10.1186/S13321-025-01003-6

access: open

type: Journal Article

metadata version: 2025-07-04

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Hiroaki Shiokawa, Shoichi Ishida, Kei Terayama:
GESim: ultrafast graph-based molecular similarity calculation via von Neumann graph entropy. J. Cheminformatics 17(1): 57 (2025)

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