nrbennet / dl_binder_design

MIT License
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in af2_initial_guess/predict.py PDB mode skips checkpoints due to inconsistent naming in self.finished_structs #86

Open xuqiqin opened 1 month ago

xuqiqin commented 1 month ago

When using pdb as input in af2_binder_design, the checkpoints are skipped due to a mismatch in naming conventions. The full pdb name is added to self.finished_structs, but the checkpoint check is performed using the tag name. Storing tag name to self.finished_structs fix the issue.