[gmx-users] scaling pressure

mojtaba alaei mo_alaei at hotmail.com
Tue Aug 20 11:49:48 CEST 2002

Dear All

Erick wrote at Sun, 18 Aug 2002 10:36:13 with subject"Re: [gmx-users] 
Amorphous polymer and periodic box":

>The normal way to simulate polymers is to have a long molecule and >let it 
>interact with itself if it's longer than the box. You'll probably have to 
>start with an extended >molecule in a very long box at higher temperature, 
>and then gradually use pressure scaling to shrink >the box (and let the 
>molecule cross the box boundary).

how can I scale pressure?

Sincerely Yours


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