Effect of molecular descriptor feature selection in support vector machine classification of pharmacokinetic and toxicological properties of chemical agents.
Xue
Y
Y
Department of Computational Science, National University of Singapore, Blk SOC1, Level 7, 3 Science Drive 2, Singapore 117543.
Li
Z R
ZR
Yap
C W
CW
Sun
L Z
LZ
Chen
X
X
Chen
Y Z
YZ
D000465:Algorithms; D006801:Humans; D010599:Pharmacokinetics; D014116:Toxicology