predict: predict properties with forward QSPR model

Description Usage Arguments Examples

View source: R/predict.R

Description

predict properties with forward QSPR model

Usage

1
predict(qsprpred, smis)

Arguments

qsprpred

QSPRpred class object

smis

SMILES strings

Examples

1
2
data(qsprpred_EG_5k)
predict(qsprpred_EG_5k, c("c1ccccc1O", "c1ccccc1F"))

iqspr documentation built on May 30, 2017, 7:09 a.m.

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