From 668ecfa2e4cb964c52181f43826f6b73cd46f5f6 Mon Sep 17 00:00:00 2001 From: Avimanyu Bandyopadhyay Date: Thu, 21 Feb 2019 19:27:03 +0530 Subject: [PATCH] Update TMA.py --- TMA.py | 2 ++ 1 file changed, 2 insertions(+) diff --git a/TMA.py b/TMA.py index 83837d7..88a73a2 100644 --- a/TMA.py +++ b/TMA.py @@ -145,6 +145,8 @@ def MergeGROMACSTrajectories(self): print "Merging both trajectories into one and generating .xtc..." print "---------------------------------------------------------" + # For GROMACS 2019.1 http://manual.gromacs.org/current/onlinehelp/gmx-trjcat.html + os.system("gmx trjcat -f %s %s -o NewMergedTrajectory.xtc" % ( xtc1, xtc2))