IPSAE with AF3- *_data.json does NOT include atom_plddts

[poojaparameswaran99]

Hi all, thank you for creating this metric to recalibrate the iPTM- very useful. I am trying to implement this with AF3 output, however, the json file is querying a key 'atom_plddts' and I believe only up until AF2, atom_plddts were saved in the *data.json, I encounter the following error:

  File "/hpc/******/ipsae.py", line 493, in <module>
    atom_plddts=np.array(data['atom_plddts'])
                         ~~~~^^^^^^^^^^^^^^^
KeyError: 'atom_plddts'

Thank you for your time.