Extract pocket descriptor for user-defined pocket

[Kartinaa]

Summary

Dear developer,

Thanks for your great work! I wonder if there is any way to extract pocket representation using unimol-tools. No matter it is atom-level, residue-level or pocket-level. Thanks!

unimol_tools Version

v0.1.5

Details

As mentioned above

[Naplessss]

Hi Kartinaa,
Thanks for your advices, we will add this feature ASAP.

[Naplessss]

update: #17