[gmx-users] position restraints

Xavier Periole x.periole at chem.rug.nl
Mon Apr 26 17:05:01 CEST 2004

Pedro Alexandre Lapido Loureiro wrote:

>Thank you David and Xavier for your replies!
>In fact, my system is a non-protein one (128 lipids + water + restrained 
>I was able to circumvent the problem changing the order of the molecules (now, 
>molecule + lipids + water).
What you did is equalling the numbering of your molecule isolated and
the molecules within the whole system.



   Xavier Periole - Ph.D.

   Dept. of Biophysical Chemistry / MD Group 
   Univ. of Groningen
   9747 AG Groningen
   The Netherlands

   Tel: +31-503634329
   Fax: +31-503634800
   email: x.periole at chem.rug.nl
   web-page: md.chem.rug.nl/~periole

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