iqspr (version 1.1)

qspr.data: sample dataset for QSPR modeling

Description

This is sample dataset for QSPR modeling. The first column is SMILES strings, and the rest 4 columns are properties.

Usage

data("qspr.data")

Examples

# NOT RUN {
data(qspr.data)
smis <- paste(qspr.data[,1])
ty <- qspr.data[,c(2,5)]
# }