HySonLab
Popular repositories
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Protein_Redesign
Protein_Redesign PublicComplex-based Ligand-Binding Proteins Redesign by Equivariant Diffusion-based Generative Models
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Ligand_Generation
Ligand_Generation PublicTarget-aware Variational Auto-encoders for Ligand Generation with Multimodal Protein Representation Learning
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Directed_Evolution
Directed_Evolution PublicProtein Design by Machine Learning guided Directed Evolution
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drug-interactions
drug-interactions PublicProject of drug interactions https://arxiv.org/pdf/2209.09941.pdf https://arxiv.org/pdf/2302.08680.pdf, NeurIPS 2022 (AI for Science)
Repositories
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- Ligand_Generation Public
Target-aware Variational Auto-encoders for Ligand Generation with Multimodal Protein Representation Learning
- Protein_Redesign Public
Complex-based Ligand-Binding Proteins Redesign by Equivariant Diffusion-based Generative Models
- HierAttention Public
Scalable Hierarchical Self-Attention with Learnable Hierarchy for Long-Range Interactions
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- GraphLASSO Public
Sparsity exploitation via discovering graphical models in multi-variate time-series forecasting
- pandemic_tgnn Public
Predicting COVID-19 pandemic by spatio-temporal graph neural networks https://arxiv.org/abs/2305.07731
- MGVAE Public
Higher-order permutation-equivariant graph variational autoencoder to generate molecules in multiresolution manner. https://iopscience.iop.org/article/10.1088/2632-2153/acc0d8