Enum MolecularDatasetLoader<T>.MolecularDataset

Namespace

AiDotNet.Data.Graph

Assembly

AiDotNet.dll

Available molecular datasets.

public enum MolecularDatasetLoader<T>.MolecularDataset

Fields

QM9 = 1

QM9 dataset (134K molecules with quantum properties)

ZINC = 0

ZINC dataset (12K drug-like molecules for benchmarking)

ZINC250K = 2

ZINC subset for molecule generation (250K molecules)