Stars
Graphormer-IR is an extension of the Graphormer framework, specifically to perform predictions of infrared spectra using only chemical structure
ProtBENCH: A Comprehensive Benchmark for Machine Learning-based Prediction of Drug/Compound-Target Interactions
ProtFeat is protein feature extraction tool that utilizes POSSUM and iFeature.
Deep Graph Infomax (https://arxiv.org/abs/1809.10341)