apset: Atom pairs stored in 'APset' object
In girke-lab/ChemmineR-release: Cheminformatics Toolkit for R
Description
Usage
Format
Details
Source
References
Examples
Description
Atom pairs for 100 molecules stored in sdfsample.
Usage
1
Format
Object of class apset
Details
Object stores atom pairs of 100 molecules.
Source
apset <- sdf2ap(sdfsample)
References
Chen X and Reynolds CH (2002). "Performance of similarity measures
in 2D fragment-based similarity searching: comparison of structural descriptors
and similarity coefficients", J Chem Inf Comput Sci.
Examples
1
2
3
girke-lab/ChemmineR-release documentation built on May 17, 2019, 5:26 a.m.
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Description Usage Format Details Source References Examples
Description
Atom pairs for 100 molecules stored in sdfsample.
Usage
1 |
Format
Object of class apset
Details
Object stores atom pairs of 100 molecules.
Source
apset <- sdf2ap(sdfsample)
References
Chen X and Reynolds CH (2002). "Performance of similarity measures in 2D fragment-based similarity searching: comparison of structural descriptors and similarity coefficients", J Chem Inf Comput Sci.
Examples
1 2 3 |
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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