rJava, rcdklibs (>= 1.5.12), methods, png, iterators,
itertools
Allows the user to access functionality in the
CDK, a Java framework for chemoinformatics. This allows the user to load
molecules, evaluate fingerprints, calculate molecular descriptors and so on.
In addition the CDK API allows the user to view structures in 2D.

c(person('Rajarshi', 'Guha', role=c('aut',"cph"), email='rajarshi.guha@gmail.com'),
person('Zachary', 'Charlop-Powers', role=c('cre'), email='zach.charlop.powers@gmail.com'),
person('Emma', 'Schymanski', role=c('ctb'), email='schymane@gmail.com'))
fingerprint, rJava, methods, png, iterators, itertools
Allows the user to access functionality in the
'CDK', a Java framework for chemoinformatics. This allows the user to load
molecules, evaluate fingerprints, calculate molecular descriptors and so on.
In addition, the 'CDK' API allows the user to view structures in 2D.
Rajarshi Guha [aut, cph],
Zachary Charlop-Powers [cre],
Emma Schymanski [ctb]

Orphaned and corrected on 2018-09-26 as issues with
recent Java versions were not corrected despite reminders.

xtable, RUnit, knitr, rmarkdown, devtools

This package provides the CDK libraries for use
in the R environment. 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

This package provides the CDK libraries for use in the R
environment. 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

c(person('Rajarshi', 'Guha', role=c('aut'), email='rajarshi.guha@gmail.com'),
person('Zachary', 'Charlop-Powers', role=c('cre'), email='zach.charlop.powers@gmail.com'),
person('CDK Project', '', role=c('ctb', 'cph'), comment='CDK Java library contained in multiple jar files'))
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.
Rajarshi Guha [aut],
Zachary Charlop-Powers [cre],
CDK Project [ctb, cph] (CDK Java library contained in multiple jar
files)