- recipe bioconductor-chemminer
Cheminformatics Toolkit for R
- Homepage:
https://bioconductor.org/packages/3.16/bioc/html/ChemmineR.html
- License:
Artistic-2.0
- Recipe:
- Links:
biotools: chemminer
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. In addition, it offers visualization functions for compound clustering results and chemical structures.
- package bioconductor-chemminer¶
-
- Versions:
3.50.0-1
,3.50.0-0
,3.46.0-2
,3.46.0-1
,3.46.0-0
,3.44.0-0
,3.42.2-0
,3.42.0-0
,3.40.0-0
,3.50.0-1
,3.50.0-0
,3.46.0-2
,3.46.0-1
,3.46.0-0
,3.44.0-0
,3.42.2-0
,3.42.0-0
,3.40.0-0
,3.38.0-0
,3.36.0-1
,3.34.1-0
,3.32.1-0
,2.30.0-0
,2.28.3-0
- Depends:
bioconductor-biocgenerics
>=0.44.0,<0.45.0
libblas
>=3.9.0,<4.0a0
libgcc-ng
>=12
liblapack
>=3.9.0,<4.0a0
libstdcxx-ng
>=12
r-base
>=4.2,<4.3.0a0
r-rcpp
>=0.11.0
- Required By:
Installation
With an activated Bioconda channel (see set-up-channels), install with:
conda install bioconductor-chemminer
and update with:
conda update bioconductor-chemminer
or use the docker container:
docker pull quay.io/biocontainers/bioconductor-chemminer:<tag>
(see bioconductor-chemminer/tags for valid values for
<tag>
)
Download stats¶
Link to this page¶
Render an badge with the following MarkDown:
[](http://bioconda.github.io/recipes/bioconductor-chemminer/README.html)