[gmx-users] still don't know how to modify my input file: Re: energy minimization runs with error like too large force

[Xavier Periole]

HR Hu wrote:

>Dear David:
>    Thanks for your kind reply so soon. But I still don't know how to
>modify the coordinates of the water 7773 generated by genbox.
>
>  
>
Edit the file and erase it !!! that would solve your problem. The
equilibration will rearrange your bulk solvent as if nothing ever
happened !!!

XAvier

-- 
----------------------------------------------

   Xavier Periole - Ph.D.

   Dept. of Biophysical Chemistry / MD Group 
   Univ. of Groningen
   Nijenborgh 4
   9747 AG Groningen
   The Netherlands

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