[AMBER] Is geometric center of atoms same as center of mass ?

From: Saikat Pal <saikatpaliitg.yahoo.com>
Date: Sat, 16 Sep 2017 07:28:39 +0000 (UTC)

Dear all,
In radial command (amber 2015 reference manual page no 586) there is "center" word present. Calculate RDF from geometric center of atoms in <solvent mask1> to all
atoms in <solute mask2>. Is geometric center of atoms same as center of mass, if not then what is it ?? 
Thanks and regards,
Saikat
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Received on Sat Sep 16 2017 - 04:00:03 PDT