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Recycle Calculated MSA during screening

Open KSUN63 opened this issue 9 months ago • 0 comments

Hi authors,

I wonder if there's any way to recycle the generated MSA if I am doing multiple inferences on the same protein but with different ligands. So far, using the default msa server, I was able to get the following items in the msa folder. Which file should I use as the msa input for my other inferences? Thanks!

--msa
   --task_name_unpaired_tmp_env
      --bfd.mgnify30.metaeuk30.smag30.a3m
      --msa.sh
      --out.tar.gz
      --pdb70.m8
      --uniref.a3m
  --task_name_0.csv

KSUN63 avatar May 28 '25 17:05 KSUN63