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binding affinity prediction

4 papers

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Co-occurring keywords · papers mentioning both

molecular representation (2) se(3) equivariant (1) protein-ligand interaction (1) protein-ligand binding prediction (1) protein-rna binding (1) bi-scope pretraining (1) differentiable pooling (1) denoising score matching (1) protein-ligand binding (1) protein structure (1)

Papers

CheapNet: Cross-attention on Hierarchical representations for Efficient protein-ligand binding Affinity Prediction ICLR 2025 CoPRA: Bridging Cross-domain Pretrained Sequence Models with Complex Structures for Protein-RNA Binding Affinity Prediction AAAI 2025 Self-supervised Pocket Pretraining via Protein Fragment-Surroundings Alignment ICLR 2024 Unsupervised Protein-Ligand Binding Energy Prediction via Neural Euler's Rotation Equation NeurIPS 2023