AstraZeneca
A collection of research papers and software related to explainability in graph machine learning.
2k 136
A PyTorch and TorchDrug based deep learning library for drug pair scoring. (KDD 2022)
Python 773 101
A general purpose recommender metrics library for fair evaluation.
Python 276 25
The official implementation of the paper, "SubTab: Subsetting Features of Tabular Data for Self-Supervised Representation Learning"
Python 151 21
OntoMerger is an ontology alignment library for deduplicating knowledge graph nodes that represent the same domain.
HTML 102 6
Fast calculation of hydrogen-bond strengths and free energy of hydration of small molecules.
Python 114 11