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March 21, 2011 at 7:11 pm
#5223
What distinguishes the different inputs in your data set? Are they different protein complexes? If so, I’d guess something is subtly wrong (or at least, subtly Rosetta-inappropriate) with some fraction of the inputs; they don’t happen to crash out at PDB reading but instead at the docking line you list.
Another possibility is that the failing set are more-than-two-body problems, and docking does not know which groups make for pairs of proteins?