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Consensus prediction of chemical reactions with OCHEM-R platform.
In: (Artificial Neural Networks and Machine Learning. ICANN 2025 International Workshops and Special Sessions). Berlin [u.a.]: Springer, 2026. 45-52 (Lect. Notes Comput. Sc. ; 16072 LNCS)
Here we describe the OCHEM-R platform, developed to propose chemical pathways based on a consensus prediction of retrosynthetic pathways using eight different methods. The developed software allows users to visualize predicted reactions and identify similar reactions using retrieval augmented generation (RAG) . The platform is publicly available at https://ochem.eu.
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Publication type
Article: Conference contribution
Keywords
Llm ; Multistep Reaction Prediction ; Pathway Visualization ; Reaction Explanation
Language
english
Publication Year
2026
HGF-reported in Year
2026
ISSN (print) / ISBN
0302-9743
e-ISSN
1611-3349
Conference Title
Artificial Neural Networks and Machine Learning. ICANN 2025 International Workshops and Special Sessions
Quellenangaben
Volume: 16072 LNCS,
Pages: 45-52
Publisher
Springer
Publishing Place
Berlin [u.a.]
Institute(s)
Institute of Structural Biology (STB)
POF-Topic(s)
30203 - Molecular Targets and Therapies
Research field(s)
Enabling and Novel Technologies
PSP Element(s)
G-503000-001
Scopus ID
105018302558
Erfassungsdatum
2025-10-22