nrbennet / dl_binder_design

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How to use the addFIXEDlabels.py script, what is the meaning for trb #70

Closed ning-2022 closed 7 months ago

ning-2022 commented 7 months ago

Hi @nrbennet

I was attempting to design a binder protein which had some fixed residues identities in a region.  So I want to use this script to label this region. However, I still don't understand how to use it properly.  In the help information, this scrip should have two options like --pdbdir  --trbdir. Could you tell me what is the exact mean for these options. what does trb represent?  In my understanding, maybe I should provide a expression like this "A41-40" to stand for the residues 41 and 40 in A chain which should be fixed in the design progress.  I guess that maybe this script could add some phrase like "FIXED" into pdb files. Please help me, any suggestion is appreciate.  

Best regards, Ning