"Graph isomorphism-based algorithm for cross-checking chemical and ..."

Andrius Merkys et al. (2023)

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DOI: 10.1186/S13321-023-00692-1

access: open

type: Journal Article

metadata version: 2023-03-21

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Andrius Merkys, Antanas Vaitkus, Algirdas Grybauskas, Aleksandras Konovalovas, Miguel Quirós, Saulius Grazulis:
Graph isomorphism-based algorithm for cross-checking chemical and crystallographic descriptions. J. Cheminformatics 15(1): 25 (2023)

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