rcdklibs: The CDK Libraries Packaged for R

An R interface to the Chemistry Development Kit, a Java library for chemoinformatics. Given the size of the library itself, this package is not expected to change very frequently. To make use of the CDK within R, it is suggested that you use the 'rcdk' package. Note that it is possible to directly interact with the CDK using 'rJava'. However 'rcdk' exposes functionality in a more idiomatic way. The CDK library itself is released as LGPL and the sources can be obtained from <https://github.com/cdk/cdk>.

Version:	2.9
Depends:	R (≥ 2.0.0), rJava
Published:	2024-03-03
DOI:	10.32614/CRAN.package.rcdklibs
Author:	Rajarshi Guha [aut], Zachary Charlop-Powers [cre], CDK Project [ctb, cph] (CDK Java library contained in multiple jar files) rcdklibs author details
Maintainer:	Zachary Charlop-Powers <zach.charlop.powers at gmail.com>
License:	LGPL-2 | LGPL-2.1 | LGPL-3 [expanded from: LGPL]
URL:	https://cdk-r.github.io/rcdklibs/
NeedsCompilation:	no
Materials:	README NEWS
In views:	ChemPhys
CRAN checks:	rcdklibs results

Documentation:

Reference manual:

rcdklibs.pdf

Downloads:

Package source:	rcdklibs_2.9.tar.gz
Windows binaries:	r-devel: rcdklibs_2.9.zip, r-release: rcdklibs_2.9.zip, r-oldrel: rcdklibs_2.9.zip
macOS binaries:	r-release (arm64): rcdklibs_2.9.tgz, r-oldrel (arm64): rcdklibs_2.9.tgz, r-release (x86_64): rcdklibs_2.9.tgz, r-oldrel (x86_64): rcdklibs_2.9.tgz
Old sources:	rcdklibs archive

Reverse dependencies:

Reverse depends:

rcdk

Linking:

Please use the canonical form https://CRAN.R-project.org/package=rcdklibs to link to this page.