OPENBABEL

Description

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.

Installations

Nord3:
Versions:
2.3.1-python
2.3.1

MinoTauro:
Versions:
2.4.1

MareNostrum 4:
Versions:
3.0.0
2.3.1

CTE-POWER:
Versions:
2.4.1