girke-lab/ChemmineR-release
Cheminformatics Toolkit for R

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SDFset2SDF: 'SDFset' to list with many 'SDF'

SDFset2SDF: 'SDFset' to list with many 'SDF'
In girke-lab/ChemmineR-release: Cheminformatics Toolkit for R

Description Usage Arguments Details Value Author(s) References See Also Examples

Description

Returns object of class SDFset as list were each component consists of an SDF object.

Usage

1
SDFset2SDF(x)

Arguments

x

object of class SDFset

Details

...

Value

list

containing one or many SDF objects

Author(s)

Thomas Girke

References

SDF format definition: http://www.symyx.com/downloads/public/ctfile/ctfile.jsp

See Also

Functions: sdfstr2list, sdf2str, sdf2list, SDFset2list

Examples

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## Instance of SDFset class
data(sdfsample); sdfset <- sdfsample
sdfset 

## Returns sdfset as list
SDFset2SDF(sdfset[1:4])
as(sdfset, "SDF")[1:4] # similar result
view(sdfset[1:4]) # same result

girke-lab/ChemmineR-release documentation built on May 17, 2019, 5:26 a.m.

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