%0 Journal Article %A Brozos, Christoforos %A Bhattacharya, Sandip %A Rittig, Jan Gerald %A Akanny, Elie %A Eiden, Philipp %A Mitsos, Alexander %T Predicting the equivalent alkane carbon number of oils using graph neural networks and quantum mechanical descriptors %J Computers & chemical engineering %V 204 %@ 0098-1354 %C Amsterdam [u.a.] %I Elsevier Science %M RWTH-2025-08714 %P 109425 %D 2026 %Z Received 10 January 2025, Revised 7 June 2025, Accepted 26 September 2025, Available online 30 September 2025 %F PUB:(DE-HGF)16 ; PUB:(DE-HGF)7 %9 Journal ArticleContribution to a book %U <Go to ISI:>//WOS:001589089400001 %R 10.1016/j.compchemeng.2025.109425 %U https://publications.rwth-aachen.de/record/1020007