Last data update: 2014.03.03
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R: Small Molecule Solubility (LogS) Data: PaDEL descriptors for...
LogSDescsTrain | R Documentation |
Small Molecule Solubility (LogS) Data: PaDEL descriptors for the taining set
Description
PaDEL descriptors have been computed for the training set.
Details
LogSDescsTrain is a data frame with PaDEL descriptors for the datapoints in the training set (30% of the LogS data).
References
Wang et al. J. Chem. Inf. Model., 2007, 47 (4), pp 1395-1404
DOI: 10.1021/ci700096r
http://pubs.acs.org/doi/abs/10.1021/ci700096r
See Also
LogS
Results
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