[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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