You can apply external forces to subsets of atoms, in such a way as to cause your box to shrink by itself.
----- Original Message ---- From: WU Yanbin <[EMAIL PROTECTED]> To: [email protected] Sent: Tuesday, October 9, 2007 11:40:21 PM Subject: [gmx-users] How to change the box size during simuation Hey, Now I'm simulating infinite molecules. I want to change the box size a lit bit every time step so as to induce some stress in this system. Is there any way in gromacs to do this, apart from modifying the code? Thanks in advance. Yours Sincerely, WU Yanbin ____________________________________________________________________________________ Fussy? Opinionated? Impossible to please? Perfect. Join Yahoo!'s user panel and lay it on us. http://surveylink.yahoo.com/gmrs/yahoo_panel_invite.asp?a=7
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