[gmx-users] Invoking parameters at startup

Jack Shultz js at drugdiscoveryathome.com
Sat Nov 14 00:55:43 CET 2009


I am trying to specify protein and LIG as groups when I start certain
analysis programs. I want to run this as part of a script. For
example, if I want to run g_rms it will prompt me to specify the two
groups we want to compare. I want to specify the groups when I start
the app. Other than re-writing the command arguments in the app, is
there a way to pass those parameters at startup?

-- 
Jack

http://drugdiscoveryathome.com
http://hydrogenathome.org



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