Re: [AMBER] Regarding MMGBSA calculation

From: David A Case <david.case.rutgers.edu>
Date: Fri, 5 Feb 2016 08:05:07 -0500

On Fri, Feb 05, 2016, neha chaudhary wrote:
>
> Fatal Error: This program was not built to run in your system.
> Please verify that both the operating system and the processor support
> Intel(R) AVX.
>
> TrajError: /share/apps/amber/amber12/bin/cpptraj failed when querying
> complex.crd

What happens if you type "/share/apps/amber/amber12/bin/cpptraj" at a console
prompt? Do the Amber test cases mostly pass?

Related question, especially if you get failures from the previous questions:
what OS and compiler are you using? what arguments did you give to Amber's
configure script?

...dac


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Received on Fri Feb 05 2016 - 05:30:03 PST
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