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XMolCap: Advancing Molecular Captioning Through Multimodal Fusion and Explainable Graph Neural Networks

Duong Thanh Tran, Nguyen Doan Hieu Nguyen, Nhat Truong Pham, Rajan Rakkiyappan, Rajendra Karki,Balachandran Manavalan

IEEE journal of biomedical and health informatics(2025)

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Key words
Explainable artificial intelligence,graph neural networks,language and molecules,large language models,molecular captioning,model interpretation,multimodal fusion
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