On Fri, Sep 12, 2025, Oscar Conchillo-Solé via AMBER wrote:
>I followed the instructions, recompiled with the new patch and
>completed the run that was crashing previoulsy (see emails to the list
>with the subject "pmemd24 problems with RTX5090" ) .
>I compared pressure, etot, temperature and density with exactly the
>same run with a 4090 and results are quite similar. (si below for
>Final Performance Info)
>
>Just one issue. At some time the following message appeared in the
>stdout / stderr:
>
>"Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG IEEE_DENORMAL"
This message is normal and expected.....dac
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Received on Fri Sep 12 2025 - 14:30:02 PDT