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octavian-ganea / equidock_public

EquiDock: geometric deep learning for fast rigid 3D protein-protein docking
MIT License
231 stars 58 forks source link

inference script has no docs #11

Open jadolfbr opened 2 years ago

jadolfbr commented 2 years ago

Great work, but I don't see any documentation for the inference script or even an ArgumentParser/etc. I think I can figure it out from the code, but but it would be nice for simple docking inference to use for predictions. Apologies if this information is somewhere else and I missed it.

lonngxiang commented 1 year ago

Great work, but I don't see any documentation for the inference script or even an ArgumentParser/etc. I think I can figure it out from the code, but but it would be nice for simple docking inference to use for predictions. Apologies if this information is somewhere else and I missed it.

same question . have any example that simply to use? @octavian-ganea octavian-ganea