[gmx-users] error

[Dallas Warren]

>Could anyone explain me what this error mean:
>FATAL ERROR: Found a second defaults directive, file "lipid.itp", line 9.
>    Please explain me this what this error mean what should be done to avoid
>this error.

Pretty sure that error has been covered on this emailing list 
previously.  If I remember correctly it is due to having two:

[ defaults ]
; nbfunc        comb-rule       gen-pairs       fudgeLJ         fudgeQQ
         1       1               no              1.0             1.0

lines within your forcefield/topology files.  Check this to make sure by 
searching the emailing list archive.  Also look at line 9 of lipid.itp, 
that will most likely be the line that is a repeat of the one found in the 
ff*.itp files you have used.

Catch ya,

Dr. Dallas Warren
Research Fellow
Department of Pharmaceutical Biology and Pharmacology
Victorian College of Pharmacy, Monash University
381 Royal Parade, Parkville VIC 3010
dallas.warren at vcp.monash.edu.au
+61 3 9903 9083
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