apset {ChemmineR} | R Documentation

## Atom pairs stored in `APset` object

### Description

Atom pairs for 100 molecules stored in `sdfsample`.

### Usage

    data(apset)

### 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

    data(apset)
    apset[1:4]
    view(apset[1:4])

[Package ChemmineR version 3.44.0 Index]