[gmx-users] Topology File

Albert Sun albert_sun9 at yahoo.com
Sun Aug 10 23:26:03 CEST 2003


Dear Users,

I wrote my own  .top  file and  ran the  em.mdp, here are errors 

WARNING 1 [file "try1.top", line 18]:
  Invalid directive atom
WARNING 2 [file "try1.top", line 22]:
  Too few parameters on line (source file toppush.c, line 673)
WARNING 3 [file "try1.top", line 23]:


could you advise me how to avoid the errors?  I  attached my .top here.

Many thanks 

Albert

 

 




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