[gmx-users] coordination number

Justin A. Lemkul jalemkul at vt.edu
Thu Aug 12 21:41:55 CEST 2010

Nilesh Dhumal wrote:
> Hello,
> I am trying to calculate the number of solvent molecular present in the
> first solvation shell.
> How can I can calculate the coordination number of solute in first
> solvation shell.

Search the list archive.  This is just one of a number of useful results for 
"coordination number":



> NIlesh


Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080


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