BBBP

Dataset Card for bbbp Dataset Summary bbbp is a dataset included in MoleculeNet. This dataset has binary labels of blood-brain barrier penetration(permeability). Dataset Structure Data Fields Each split contains smiles: the SMILES representation of a molecule selfies: the SELFIES representation of a molecule target: bl

Papers using BBBP (4)

Quantum Long Short-Term Memory for Drug Discovery2024 · 3 citesDumpling GNN: Hybrid GNN Enables Better ADC Payload Activity Prediction Based on Chemical Structure2024 · 1 citesGLaD: Synergizing Molecular Graphs and Language Descriptors for Enhanced Power Conversion Efficiency Prediction in Organic Photovoltaic Devices2024Efficient Training of Transformers for Molecule Property Prediction on Small-scale Datasets2024