<br><br>On Sat, Apr 14, 2012 at 6:12 PM, Justin A. Lemkul <<a href="mailto:jalemkul@vt.edu">jalemkul@vt.edu</a>> wrote:<br>><br>><br>><br>>> Hi Justin,<br><br> Thank you for reply..<br>>><br>
>><br>>><br>>> My query is ..Why Pressure Coupling is off in production MD run ???<br>>><br>><br>> Pressure coupling is on, hence:<br>><br>> pcoupl = Parrinello-Rahman<br>> <br>
<br>That means sentence<br><br>; Pressure coupling is off<br><br> Is not valide when user write...(Specify the coupling parameter in<br> front of option)<br><br>pcoupl = Parrinello-Rahman<br><br><br><br><br>Thank you <br>
With Best Wishes,<br><br><br>