Logo of Science Foundation Ireland  Logo of the Higher Education Authority, Ireland7 CapacitiesGPGPU Research Projects
Ireland's High-Performance Computing Centre | ICHEC
Home | News | Infrastructure | Outreach | Services | Research | Support | Education & Training | Consultancy | About Us | Login

ICHEC Software

Information about software packages installed on the ICHEC systems.


Versions Installed

Stokes: 2.3.0 / 2.3.1

Stoney: 2.3.0


Open Babel is an open source software package for searching, converting, analyzing, and storing chemical data.


Open Babel is free software distributed under the GPL license



Additional Notes

To use openbabel load the relevant environment module:

module load openbabel/2.3.0

The openbabel module also includes other packages: oasa v0.13.1, Imaging v1.1.7, and from silicos: pharao v3.0.3, sieve v3.1.0, piramid v1.0.1, and stripper v1.0.4.

Return to the software index