[gmx-users] Tetrahedral order

Omkar Singh omkantnirala92 at gmail.com
Tue Jul 9 10:25:00 CEST 2019


Dear all,
I want to calculate the Tetrahedral order parameter through gmx. Can anyone
help? Eventhough I tried but my system has 500 water molecules Fir that I
am unable to make index file because it will take lots of time for typing
any suggestions. Commend
gmx order -f .xtc -s .tpr -b 0 -e 10000 -n .ndx -nr .ndx  -d y -permolecule


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