Classification models of structure - P-glycoprotein activity of drugs

Grigorev V.Yu., Solodova S.L., Polianczyk D.E., Raevsky O.A.

Year: 2016 Vol: 62 Issue: 2 Pages: 173-179

Supplementary materials:

1.The description of learning and testing sets.PBMC-2016-62-2-173-S1.pdf
2.7 descriptors for learning and testing sets. PBMC-2016-62-2-173-S2.pdf
3.1064 DRAGON descriptors for learning and testing sets.PBMC-2016-62-2-173-S3.pdf
4.The legend of DRAGON descriptors.PBMC-2016-62-2-173-S4.pdf