AIDS Dataset

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.

AIDS乃为一图数据集，汇集了2000个代表分子化合物的图，这些化合物源自于AIDS抗病毒筛选数据库中的活性化合物。该数据集包含4395种化学物质，其中423种属于CA类别，1081种属于CM类别，其余化合物则归属于CI类别。