AP_simCMAP: Structure Similarity compound-CMAPset
In Elisa89m/PDSP: Phenotypic Drug Similarity Prediction
Description
Usage
Arguments
Value
Description
Compute the structure similarity score between the selected compound and the compounds of CMAP
Usage
1
AP_simCMAP(apset_comp, apsetCMAP)
Arguments
apset_comp
APset object containing the Atom Pair descriptors of new compound(s)
apsetCMAP
APset object containing all Atom Pair descriptors of CMAP compounds
Value
data.frame (Nx1) with similarity score between new_compound and apsetCMAP
Elisa89m/PDSP documentation built on May 30, 2019, 1:26 p.m.
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.
Description Usage Arguments Value
Description
Compute the structure similarity score between the selected compound and the compounds of CMAP
Usage
1 | AP_simCMAP(apset_comp, apsetCMAP)
|
Arguments
apset_comp |
APset object containing the Atom Pair descriptors of new compound(s) |
apsetCMAP |
APset object containing all Atom Pair descriptors of CMAP compounds |
Value
data.frame (Nx1) with similarity score between new_compound and apsetCMAP
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.
Embedding an R snippet on your website
Add the following code to your website.
For more information on customizing the embed code, read Embedding Snippets.