[gmx-users] geometric center

Dastmalchi dastmalchi.s at tbzmed.ac.ir
Wed Sep 3 05:55:01 CEST 2003


Hi,

How can I calculate the geometric center for part of a protein structure. I have crated index.ndx file for the interested residues, but don't know what is the command to calculate the geometric center for these residues.

Many thanks for your help in advance.

Cheers, Siavoush
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