[gmx-users] Fwd: Merging different topology files
Momin Ahmad
momin.ahmad at kit.edu
Thu Sep 7 16:20:45 CEST 2017
weird, my email got cut off
-------- Weitergeleitete Nachricht --------
Betreff: Merging different topology files
Datum: Thu, 7 Sep 2017 16:19:29 +0200
Von: Momin Ahmad <momin.ahmad at kit.edu>
An: gmx-users at gromacs.org
Hello all,
is there a simple way to merge two or more topology files into one? I am
trying to use grompp to set up a simulation but my solvation contains
different molecules which have different .top files. I also tried
creating a main topology file which includes the other two topologies
but without success. Hope anyone knows how to solve this.
Best,
Momin
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