[gmx-users] Re: Force vs distance plot in pulling simulation?
gmxquestions at gmail.com
Sat Nov 17 14:38:43 CET 2012
Hi Erik and Justin
Thanks, writing such a script is easy.
The point of it all would be to be able to map the magnitude of the pulling
force to what I see happen in the pulling simulation. How else would you
get an understanding of what the pulling force means?
> > The only solution is to write a simple script that parses out the
> columns you want.
> > -Justin
> I don't see the point though. Except for checking implementation of the
> pull code.
> Erik Marklund, PhD
> Dept. of Cell and Molecular Biology, Uppsala University.
> Husargatan 3, Box 596, 75124 Uppsala, Sweden
> phone: +46 18 471 6688 fax: +46 18 511 755
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