AIDS

Dataset Information
Modalities
Graphs
Introduced
2008
License
Homepage

Overview

AIDS is a graph dataset. It consists of 2000 graphs representing molecular compounds which are constructed from the AIDS Antiviral Screen Database of Active Compounds. It contains 4395 chemical compounds, of which 423 belong to class CA, 1081 to CM, and the remaining compounds to CI.

Source: DGCNN: Disordered Graph Convolutional Neural Network Based on the Gaussian Mixture Model
Image Source: https://www.researchgate.net/figure/Sample-component-in-AIDS-kernel-dataset-with-Graphwave-based-structural-role-colors-Here_fig1_338282222

Variants: AIDS

Associated Benchmarks

This dataset is used in 2 benchmarks:

Recent Benchmark Submissions

Task Model Paper Date
Continual Learning TEST Advances and Challenges in Foundation … 2025-03-31
Graph Classification FIT-GNN FIT-GNN: Faster Inference Time for … 2024-10-19
Graph Classification DGCNN DGCNN: Disordered Graph Convolutional Neural … 2017-12-10

Research Papers

Recent papers with results on this dataset: