Re: [AMBER] Water do not see the system....

From: Daniel Roe <>
Date: Thu, 11 Oct 2018 11:59:04 -0400


On Thu, Oct 11, 2018 at 11:56 AM Vito GENNA <> wrote:
> Apparently, intel/2018.3 is not efficient for amber18.

Did you by any chance run the test cases with intel 2018.3 compiled
code? If so, did they pass?

In the meantime I'll check into this on my local cluster. Thanks for the report.


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Received on Thu Oct 11 2018 - 09:00:04 PDT
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