On Wed, Sep 12, 2012, Buback, Clayton (S&T-Student) wrote:
>
> I am trying to run a novel, non-biomolecule system containing 72
> atoms. Following the Antechamber tutorial, I have successfully created
> a mol2 file. However, when I run the parmchk command, it returns this
> error:
>
> "Memory allocation error on *atom"
Can you post your mol2 file? We need to see if we can reproduce the problem.
...thx...dac
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Received on Thu Sep 13 2012 - 06:00:03 PDT
