Pinned Repositories
biopandas
Working with molecular structures in pandas DataFrames
HAC-Net
HAC-Net: A Hybrid Attention-Based Convolutional Neural Network for Highly Accurate Protein-Ligand Binding Affinity Prediction
pytorch-lightning
Pretrain, finetune and deploy AI models on multiple GPUs, TPUs with zero code changes.
plantain
Fast and accurate molecular docking with an AI pose scoring function
pytorch_geometric
Graph Neural Network Library for PyTorch
cbb752_SmithWaterman
Implementation of the Smith-Waterman Sequence Alignment Algorithm
gvp-pytorch
Geometric Vector Perceptrons --- a rotation-equivariant GNN for learning from biomolecular structure
pytorch_geometric
Graph Neural Network Library for PyTorch
RafiBrent's Repositories
RafiBrent/cbb752_SmithWaterman
Implementation of the Smith-Waterman Sequence Alignment Algorithm
RafiBrent/gvp-pytorch
Geometric Vector Perceptrons --- a rotation-equivariant GNN for learning from biomolecular structure
RafiBrent/pytorch_geometric
Graph Neural Network Library for PyTorch