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ProteinTutorial_AAAI2025
PublicULTRA
PublicGraphAny
PublicGearBind
Publictorchdrug
PublicA powerful and flexible machine learning platform for drug discoverygraphvite
PublicGraphVite: A General and High-performance Graph Embedding SystemDiffPack
PublicImplementation of DiffPack: A Torsional Diffusion Model for Autoregressive Protein Side-Chain Packing- GearNet and Geometric Pretraining Methods for Protein Structure Representation Learning, ICLR'2023 (https://arxiv.org/abs/2203.06125)
project
PublicESM-GearNet
PublicESM-GearNet for Protein Structure Representation Learning (https://arxiv.org/abs/2303.06275)GNN-QE
PublicOfficial implementation of Graph Neural Network Query Executor (ICML 2022)AStarNet
PublicNBFNet
PublicOfficial implementation of Neural Bellman-Ford Networks (NeurIPS 2021)torchdrug-site
Public- Code for Pre-training Protein Encoder via Siamese Sequence-Structure Diffusion Trajectory Prediction (https://arxiv.org/abs/2301.12068)
PEER_Benchmark
PublicPEER Benchmark, appear at NeurIPS 2022 Dataset and Benchmark Track (https://arxiv.org/abs/2206.02096)torchprotein-site
PublicInductiveQE
PublicRNNLogic
PublicMath80600A_2022W
PublicContinuousGNN
Public