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Integrating a multitask graph neural network with DFT calculations for site-selectivity prediction of arenes and mechanistic knowledge generation
Research article (Nature Synthesis, 2025) · cited 10× · AI/ML
Integrating a multitask graph neural network with DFT calculations for site-selectivity prediction of arenes and mechanistic knowledge generation
Summary
Integrating a multitask graph neural network with DFT calculations for site-selectivity prediction of arenes and mechanistic knowledge generation is a scholarly article[1].
Key Facts
Integrating a multitask graph neural network with DFT calculations for site-selectivity prediction of arenes and mechanistic knowledge generation's instance of is recorded as scholarly article[2].
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APA4ort.xyz Knowledge Graph. (2026). Integrating a multitask graph neural network with DFT calculations for site-selectivity prediction of arenes and mechanistic knowledge generation. Retrieved May 24, 2026, from https://4ort.xyz/entity/integrating-a-multitask-graph-neural-network-with-dft-calculations-for-site-selectivity-prediction-of-arenes-and-mechani
MLA“Integrating a multitask graph neural network with DFT calculations for site-selectivity prediction of arenes and mechanistic knowledge generation.” 4ort.xyz Knowledge Graph, 4ort.xyz, 24 May. 2026, https://4ort.xyz/entity/integrating-a-multitask-graph-neural-network-with-dft-calculations-for-site-selectivity-prediction-of-arenes-and-mechani.
BibTeX@misc{4ortxyz_integrating-a-multitask-graph-neural-network-with-dft-calculations-for-site-selectivity-prediction-of-arenes-and-mechani_2026, author = {{4ort.xyz Knowledge Graph}}, title = {{Integrating a multitask graph neural network with DFT calculations for site-selectivity prediction of arenes and mechanistic knowledge generation}}, year = {2026}, url = {https://4ort.xyz/entity/integrating-a-multitask-graph-neural-network-with-dft-calculations-for-site-selectivity-prediction-of-arenes-and-mechani}, note = {Accessed: 2026-05-24}}
LLM promptAccording to 4ort.xyz Knowledge Graph (aggregator of Wikidata, Wikipedia, and authoritative open-data sources): Integrating a multitask graph neural network with DFT calculations for site-selectivity prediction of arenes and mechanistic knowledge generation — https://4ort.xyz/entity/integrating-a-multitask-graph-neural-network-with-dft-calculations-for-site-selectivity-prediction-of-arenes-and-mechani (retrieved 2026-05-24)
