Open MJLMills opened 9 years ago
This requires a conversion script for taking an AIMAll topology and converting it to a .top file. Some work has been done on this but much is left.
This is done for molecular graphs, but support for drawing surfaces is not included.
The majority of the Perl code for this is now present.
This requires a conversion script for taking an AIMAll topology and converting it to a .top file. Some work has been done on this but much is left.