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Author

Shu-Chen Sun

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Open access Oct 2026

Protein–Protein Interface Residue Prediction by Integrating Protein Language Representations and Structural Graph Attention

Accurate residue-level prediction of protein–protein interaction interfaces is important for elucidating molecular recognition mechanisms and guiding targeted drug design. However, interface residues are relatively sparse and governed by complex spatial dependencies, making their accurate identification challenging....

Zhen Hou, Wei He, Wei-Nan Cao et al. · 0 citations
#artificial intelligence Preprint Oct 2026

A self-learning scientific agent for X-ray diffraction

A central challenge for scientific agents is to turn analytical experience into reusable expertise grounded in physical evidence. Here we introduce Gan Jiang, a self-learning agent for powder X-ray diffraction built on a diffraction-analysis ecosystem we developed: XMatcher, XQueryer, XDecomposer and WPEM. Together, th...

Bin Cao, Hui-Chi Zhou, Ru-Yun Yang et al. · 0 citations

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