Member Site › Forums › Rosetta 3 › Rosetta 3 – General › Using Degenerate Protons in Rosetta3.x › Reply To: Using Degenerate Protons in Rosetta3.x
June 17, 2011 at 8:20 pm
#5783
Anonymous
It has belatedly occurred to me that part of the problem may be centroid/fullatom. If you are doing abinitio modeling, it starts in centroid mode; only the amide proton is actually in the structure. That’s the clear difference between the failing lines and the not-failing lines. I have no idea why AtomPair with HGs doesn’t fail on non-existent atoms if that is indeed the cause of the failure.