Re: [AMBER] What is happening in my Molecular Dynamics in the beginning of every 500 steps ?

From: David A Case <>
Date: Sat, 6 Jun 2020 21:07:27 -0400

On Sun, Jun 07, 2020, Erdem Yeler wrote:

>Dear Carlos and David here is my mdinfo file:

Carlos wanted your *mdin* (input) file, not the mdinfo file. And Dave's
request for the actual arguments you gave to sander (or pmemd) is a good
one. Are you do multiple runs, or seeming something odd every 500 steps
of a single run?


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Received on Sat Jun 06 2020 - 18:30:02 PDT
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