example_chem: Example Data for Compounds

Description Usage Value Author(s) Source

Description

Blood-Brain-Barrier (BBB) is a permeability barrier for maintaining homeostasis of Central Nervous System (CNS). The data is a curated compound dataset with known BBB permeability. Compounds are divided into two groups according to whether the brain to blood concentration ratio was greater or less than 0.1. The row name labels each row with the compound name.

Usage

1

Value

compound data

Author(s)

Dongmin Jung

Source

Gao, Z., Chen, Y., Cai, X., & Xu, R. (2017). Predict drug permeability to blood-brain-barrier from clinical phenotypes: drug side effects and drug indications. Bioinformatics, 33(6), 901-908.


dongminjung/DeepPINCS documentation built on Dec. 20, 2021, 12:13 a.m.