[gmx-users] Grompp error

Farid Sa'adedin fsaadedi at staffmail.ed.ac.uk
Thu Dec 1 17:52:51 CET 2005


Dear Users,

I have added Cl ion to my peptide in water system pdb and topology files.
But I have a problem when I run grompp:

Fatal Error: Atoms in the .top are not numbered consecutively from 1.

The pdb is numbered correctly and I have added the the spc.itp and 
clion.itp to the topology file.

Any ideas would be appreciated

Thank you in advance.

Farid Sa'adedin

-- 
Farid Sa'adedin
Membrane Biophysics Laboratory
Department of Veterinary Biomedical Sciences
College of Medicine & Veterinary Medicine
Royal (Dick) School of Veterinary Studies
University of Edinburgh
Summerhall
Edinburgh EH9 1QH
SCOTLAND





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