[gmx-users] .mdp file
Mark.Abraham at anu.edu.au
Tue Aug 9 10:41:14 CEST 2011
On 9/08/2011 5:26 PM, manoj damale wrote:
> Hey hi
> i want to do gromacs tutorial and for that i required the .mdp file
> for where i can get that file
The tutorial will tell you how to get it or create it.
> and what type of modification should i do in that file
Whatever the tutorial suggests. What modifications are best suited for
your own work later is something you will have to judge with the
experience you have gained. Do all the tutorial material you can find,
read textbooks and read current literature widely. Then think hard and
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