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Sponsored Design Multi-Agent AI Systems Using MCP and A2A: Engineer your own Pyt Design Multi-Agent AI Systems Using MCP and A2A: Engineer your own Pyt

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Feng-Yin Li

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#graph neural networks Open access Sep 2026

CD-BAN: Cyclodextrin Bilinear Attention Network for Inclusion Complex Affinity Classification

Source code for CD-BAN, a dual-branch graph neural network with a bilinear cross-attention layer that classifies drug-cyclodextrin inclusion-complex binding affinity (Strong: K > 10,000 M⁻¹ vs. Weak: K < 100 M⁻¹) from 2D SMILES alone, without 3D geometry or handcrafted descriptors. Trained only on the binary extremes,...

Chih‐Yang Cheng, Yi‐Huan Wu, Feng-Yin Li · 0 citations
#graph neural networks Open access Sep 2026

CD-BAN: Cyclodextrin Bilinear Attention Network for Inclusion Complex Affinity Classification

Source code for CD-BAN, a dual-branch graph neural network with a bilinear cross-attention layer that classifies drug-cyclodextrin inclusion-complex binding affinity (Strong: K > 10,000 M⁻¹ vs. Weak: K < 100 M⁻¹) from 2D SMILES alone, without 3D geometry or handcrafted descriptors. Trained only on the binary extremes,...

Chih‐Yang Cheng, Yi‐Huan Wu, Feng-Yin Li · 0 citations

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