"Predicting the equivalent alkane carbon number of oils using graph neural ..."

Christoforos Brozos et al. (2026)

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DOI: 10.1016/J.COMPCHEMENG.2025.109425

access: open

type: Journal Article

metadata version: 2025-11-15

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Christoforos Brozos, Sandip Bhattacharya, Jan G. Rittig, Elie Akanny, Philipp Eiden, Alexander Mitsos:
Predicting the equivalent alkane carbon number of oils using graph neural networks and quantum mechanical descriptors. Comput. Chem. Eng. 204: 109425 (2026)

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