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rcdk (version 2.8.1)

rcdk - Interface to the CDK Libraries

Description

This package allows the user to access functionality in the CDK, a Java framework for cheminformatics. 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.

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Install

install.packages('rcdk')

Monthly Downloads

1,455

Version

2.8.1

License

LGPL

Maintainer

Last Published

April 7th, 2008

Functions in rcdk (2.8.1)