r-rcdk 3.8.2
Dependencies: openjdk@25
Propagated dependencies: r-rjava@1.0-11 r-rcdklibs@2.9 r-png@0.1-8 r-itertools@0.1-3 r-iterators@1.0.14 r-fingerprint@3.5.7
Channel: guix-cran
Home page: https://github.com/CDK-R/cdkr
Licenses: LGPL 2.0+
Synopsis: Interface to the 'CDK' Libraries
Description:
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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