[gmx-users] Molecular volume from trajectory

Андрей Гончар gontchar at gmail.com
Tue Feb 4 11:53:31 CET 2014

Hi all
Is there a tool to calculate molecular volume for a whole MD trajectory?
I.e. I'd like to see how does the molecule changes its volume during MD.
I know that there are many external tools for this purpose, but maybe I'm
wrong and GROMACS already has something for that?
Thanks in advance
Andrew Gonchar
Андрей Гончар

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