Package: r-cran-rcdk (3.8.1+dfsg-1)

[ Source: r-cran-rcdk  ]

GNU R interface to the 'CDK' libraries

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.

Other Packages Related to r-cran-rcdk

• dep: libcdkr-java

  chemistry library combining R with CDK

• dep: r-api-4.0

  virtual package provided by r-base-core

• dep: r-cran-fingerprint

  GNU R functions to operate on binary fingerprint data

• dep: r-cran-iterators

  GNU R iterator support for vectors, lists and other containers

• dep: r-cran-itertools

  Iterator Tools

• dep: r-cran-png

  GNU R package to read and write PNG images

• dep: r-cran-rcdklibs (>= 2.8)

  Chemistry Development Kit (CDK) libraries packaged for GNU R

• dep: r-cran-rjava

  GNU R low-level interface to Java

• rec: r-cran-devtools

  Tools to Make Developing R Packages Easier

• rec: r-cran-knitr

  GNU R package for dynamic report generation using Literate Programming

• rec: r-cran-rmarkdown

  convert R markdown documents into a variety of formats

• rec: r-cran-runit

  GNU R package providing unit testing framework

• rec: r-cran-xtable

  GNU R coerce data to LaTeX and HTML tables

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