recipe openbabel/2.3.2

Open Babel is a chemical toolbox designed to speak the many languages of chemical data. It’s an open, collaborative project allowing anyone to search, convert, analyze, or store data from molecular modeling, chemistry, solid-state materials, biochemistry, or related areas.

Homepage

http://openbabel.org

License

GPL

Recipe

/openbabel/2.3.2/meta.yaml

package openbabel

(downloads) docker_openbabel

Versions

2.4.1-5, 2.4.1-3, 2.4.1-2, 2.4.1-1, 2.4.1-0, 2.3.90dev7d621d9-0, 2.3.2-2, 2.3.2-1

Depends bzip2

>=1.0.6,<2.0a0

Depends cairo

>=1.16.0,<1.17.0a0

Depends libgcc-ng

>=7.3.0

Depends libxml2

>=2.9.8,<2.10.0a0

Depends python

>=2.7,<2.8.0a0

Depends xorg-libsm

Depends xorg-libxau

Depends xorg-libxdmcp

Depends xorg-libxext

Depends xorg-libxrender

Depends zlib

>=1.2.11,<1.3.0a0

Requirements

Installation

With an activated Bioconda channel (see 2. Set up channels), install with:

conda install openbabel

and update with:

conda update openbabel

or use the docker container:

docker pull quay.io/biocontainers/openbabel:<tag>

(see openbabel/tags for valid values for <tag>)