[gmx-users] Elastic network model
Bogdan Costescu
bcostescu at gmail.com
Fri Aug 31 22:23:26 CEST 2012
On Fri, Aug 31, 2012 at 8:42 PM, mohan maruthi sena
<maruthi.sena at gmail.com> wrote:
> Hi all,
> I have built topology for elastic network as follows(the
> atoms which fall with in a distance less than 6 angtroms are bonded).
> [bonds]
> ;ai aj funct bo kb
> 2 1 1 3.80444752888 61.9
Less than 6 Angstrom ??? You need to read the topology chapter of the
manual again. And then again. It will save you lots of time later.
Hint: some units are wrong.
Good luck!
Bogdan
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