Re: [AMBER] single point energy examples

From: David A Case via AMBER <amber.ambermd.org>
Date: Sun, 2 Mar 2025 16:40:25 -0700

On Sun, Mar 02, 2025, Benjamin Shugaev via AMBER wrote:

>The thing is i am trying to install and compile Amber properly on the PBS
>server and i am having some difficulties, it would really help if you could
>refer me to some examples or test cases i could use to check whether Amber
>is installed and compiled properly.

Please see Section 2.1 (especially item 6, "testing") in the Amber24
Reference Guide.

...good luck...dac


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Received on Sun Mar 02 2025 - 16:00:02 PST
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