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OpenBabel

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.

https://openbabel.org

Available modules

The overview below shows which OpenBabel installations are available per target architecture in EESSI, ordered based on software version (new to old).

To start using OpenBabel, load one of these modules using a module load command like:

module load OpenBabel/3.1.1-gompi-2023a

(This data was automatically generated on Sat, 21 Feb 2026 at 13:03:00 UTC)

aarch64/generic aarch64/a64fx aarch64/neoverse_n1 aarch64/neoverse_v1 aarch64/nvidia/grace x86_64/generic x86_64/amd/zen2 x86_64/amd/zen3 x86_64/amd/zen4 x86_64/intel/cascadelake x86_64/intel/haswell x86_64/intel/icelake x86_64/intel/sapphirerapids x86_64/intel/skylake_avx512
OpenBabel/3.1.1-gompi-2023a x x x x x x x x x x x x x x