On 19/09/2011 2:02 AM, Steven Neumann wrote:
Hi Gromacs Users,
Can anyone explain me why in g_bond the distance is takes <= 3.5nm.
If you mean g_hbond, and are using units incorrectly, 0.35nm would be a
characteristic distance cut-off for deciding whether a hydrogen bond
might exist....
It is said that it comes from the first minimum o RDF of Oxygen atoms
in SPC water model. I am sorry, but I just do not catch this. Thank
you in advance.
Said where? About what? :)
Mark
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