stephwills's Stars
rsanchezgarc/docker-neo4j
A specialised build of neo4j used by a number of projects
diamondspark/PSG-BAR
This is the code for our paper Ligand Binding Prediction using Protein Structure Graphs and Residual Graph Attention Networks
FreyrS/dMaSIF
oxpig/CoPriNet
Deep learning for compound price prediction
junxia97/awesome-pretrain-on-molecules
[IJCAI 2023 survey track]A curated list of resources for chemical pre-trained models