Dear Bharat,
Maybe because you are trying to mutate Gly to Ala residue?
On Sun, Oct 25, 2015 at 4:46 PM, bharat lakhani <lakhbharat.gmail.com>
wrote:
> Dear Amber users
>
> I am running ALA scanning on the Protein-DNA complex. While i am running
> ALA scanning module. Following error is interrupting the calculation. I
> could not able to get my head around. Thanks
>
> Loading and checking parameter files for compatibility...
> sander found! Using /home/apps/amber/12cpu-only/bin/sander
> cpptraj found! Using /home/apps/amber/12cpu-only/bin/cpptraj
> Preparing trajectories for simulation...
> Mutating trajectories...
> MutantResError: Mutant residue 14 is ALA but must be GLY!
> Exiting. All files have been retained.
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Received on Sun Oct 25 2015 - 11:30:03 PDT
