alcohol: Alcohol data
In RobStatTM: Robust Statistics: Theory and Methods
alcohol R Documentation
Alcohol data
Description
This data set contains physicochemical characteristics of 44 aliphatic alcohols.
The aim of the experiment was the prediction of the solubility on the basis of
molecular descriptors.
Usage
data(alcohol)
Format
An object of class "data.frame".
Details
Format: 44 cases and 7 continuous variables.
The columns are:
1. SAG=solvent accessible surface-bounded molecular volume
2. V=volume
3. log PC (PC=octanol–water partitions coefficient)
4. P=polarizability
5. RM=molar refractivity
6. Mass
7. log(Solubility) (response)
Source
Romanelli, G.P., Martino, C.M. and Castro, E.A. (2001), Modeling the
solubility of aliphatic alcohols via molecular descriptors, Journal of the Chemical
Society of Pakistan, 23, 195-199.
Examples
data(alcohol)
RobStatTM documentation built on Nov. 28, 2023, 1:11 a.m.
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| alcohol | R Documentation |
Alcohol data
Description
This data set contains physicochemical characteristics of 44 aliphatic alcohols. The aim of the experiment was the prediction of the solubility on the basis of molecular descriptors.
Usage
data(alcohol)
Format
An object of class "data.frame".
Details
Format: 44 cases and 7 continuous variables. The columns are: 1. SAG=solvent accessible surface-bounded molecular volume 2. V=volume 3. log PC (PC=octanol–water partitions coefficient) 4. P=polarizability 5. RM=molar refractivity 6. Mass 7. log(Solubility) (response)
Source
Romanelli, G.P., Martino, C.M. and Castro, E.A. (2001), Modeling the solubility of aliphatic alcohols via molecular descriptors, Journal of the Chemical Society of Pakistan, 23, 195-199.
Examples
data(alcohol)
R Package Documentation
Browse R Packages
We want your feedback!
Note that we can't provide technical support on individual packages. You should contact the package authors for that.
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