Comments (2)
Hi, could you provide the pdb files and command you run so that I can try to reproduce the issue?
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Sorry, I can't reproduce your problem. Here is what I get when I run your example:
~$ DockQ 2PVC_B_7_D.out.decoy.271.pdb 2PVC_B_D.pdb
WARNING:root:Some chains have a limited number of sequence mismatches and are treated as non-homologous.
Try increasing the --allowed_mismatches for the following: Model chain D, native chain B: 2 mismatches, Model chain B, native chain D: 2 mismatches
if they should be treated as homologous.
****************************************************************
* DockQ *
* Docking scoring for biomolecular models *
* DockQ score legend: *
* 0.00 <= DockQ < 0.23 - Incorrect *
* 0.23 <= DockQ < 0.49 - Acceptable quality *
* 0.49 <= DockQ < 0.80 - Medium quality *
* DockQ >= 0.80 - High quality *
* Ref: Mirabello and Wallner, 'DockQ v2: Improved automatic *
* quality measure for protein multimers, nucleic acids *
* and small molecules' *
* *
* For comments, please email: [email protected] *
****************************************************************
Model : 2PVC_B_7_D.out.decoy.271.pdb
Native : 2PVC_B_D.pdb
Total DockQ over 1 native interfaces: 0.070 with BD:BD model:native mapping
Native chains: B, D
Model chains: B, D
DockQ: 0.070
iRMSD: 6.312
LRMSD: 19.639
fnat: 0.000
fnonnat: 1.000
F1: 0.000
clashes: 1
from dockq.
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