[gmx-users] Re: Fatal error: Atomtype O2 not found

Justin A. Lemkul jalemkul at vt.edu
Sat Jun 9 14:31:29 CEST 2012

On 6/9/12 8:30 AM, ramaraju801 wrote:
> yes, when creating the topology file i added atom O2 to the .rtp file when it
> said atom O2 is missing in atomstype

It would be useful to show us what you're doing and explain what you're 
attempting.  But the answer remains the same - you cannot use atom types that 
don't exist.



Justin A. Lemkul, Ph.D.
Research Scientist
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080


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