ChemmineR 3.44.0
:: DESCRIPTION
ChemmineR is a cheminformatics package for analyzing drug-like small molecule data in R. Its latest version contains functions for efficient processing of large numbers of molecules, physicochemical/structural property predictions, structural similarity searching, classification and clustering of compound libraries with a wide spectrum of algorithms.
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::DEVELOPER
:: SCREENSHOTS
n/a
:: REQUIREMENTS
- Linux/ MacOsX/Windows
- R package
- BioConductor
:: DOWNLOAD
:: MORE INFORMATION
Citation
Bioinformatics. 2008 Aug 1;24(15):1733-4. doi: 10.1093/bioinformatics/btn307.
ChemmineR: a compound mining framework for R.
Cao Y, Charisi A, Cheng LC, Jiang T, Girke T.