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A software package for fullerenes and their functionalized derivatives
...The CSIOpt program predicts the most stable isomers of charged fullerenes and endohedral metallofullerenes.
The XSIOpt program predicts the most stable addition patterns for a given endohedral fullerene C2nX2m.
For downloading FullFun, please go to our new web page:
https://campusys.qui.uam.es/?page_id=1491
We've moved to https://github.com/tjod/gMol/wiki
gMol is an interactive visualization system used to display and manipulate 3-dimensional models of scientific data, such as molecular structures and surfaces. It contains both OpenGL and web browser widgets that enable flexible user interfaces.