Node Property Prediction

The Open Graph Benchmark (OGB) is a collection of realistic, large-scale, and diverse benchmark datasets for machine learning on graphs. OGB datasets are automatically downloaded, processed, and split using the OGB Data Loader. The model performance can be evaluated using the OGB Evaluator in a unified manner. OGB is a community-driven initiative in active development. Source: https://ogb.stanford.edu/ Image Source: https://ogb.stanford.edu/

The AMiner Dataset is a collection of different relational datasets. It consists of a set of relational networks such as citation networks, academic social networks or topic-paper-autor networks among others.

The CHILI-100K dataset is a large-scale graph dataset (with overall >183M nodes, >1.2B edges) of nanomaterials generated from experimentally determined crystal structures. The crystal structures used in CHILI-100K are obtained from a curated subset from the Crystallography Open Database (COD) and has a broad chemical scope covering database entries for 68 metals and 11 non-metals.

The CHILI-3K dataset is a medium-scale graph dataset (with overall >6M nodes, >49M edges) of mono-metallic oxide nanomaterials generated from 12 selected crystal types. This dataset has a narrow chemical scope focused on an interesting part of chemical space with a lot of active research.