[gmx-users] combine two gro into one

Sikandar Mashayak symashayak at gmail.com
Fri May 14 04:57:53 CEST 2010


I need to do water channel simulations... I have two gro files with me...one
for wall atoms and one for water atoms...assuming the co-ordinates of atoms
are appropriate, I just need to rename the indices of each atom
appropriately and append one file to another....I plan to do it by
hand...but it will be great if there is an automatic way of doing it in
gromacs?

thanks
sikandar
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