On 29/12/2010 10:12 PM, ahmet yıldırım wrote:
Dear users,
a...@ubuntu:~/Desktop/3O87$ pdb2gmx -f 3O87.pdb -water tip3p
Select the Force Field:
5: OPLS-AA/L all-atom force field (2001 aminoacid dihedrals)
Fatal error:
Chain identifier 'A' was used in two non-sequential blocks (residue
710, atom 54 49)
What should I do to correct this error?
Look at the entries whose chain identifier is A, and see why they are
non-sequential, and take suitable action to remedy. You may need to
Google for the PDB file format if you don't already understand it.
Mark
Thanks in advance
--
Ahmet YILDIRIM
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