.mat from .basis or .raw

Analysis / Modeling Basis Sets
1

Hi all,

is there a code/tool to convert LCModel .basis (or the .RAW files that were used to create this .basis) into .mat files for INSPECTOR?

Thanks in advance!

Andrei

2

Hi Andrei, good to see you here. I don’t think so - INSPECTOR is not open-source AFAIK, so you’d need to get in touch with the team themselves.

1 Like
3

Thanks Georg! Shall do.