On 11/07/2012 05:56 PM, Angel Herráez wrote:
>
> That's great!
> Thank you, Rolf and Paul
>
> "show chain" works nicely for me.
>
> "{*}.chain.count().size" sounds better and is ok in Jmol 13, but I'm
> tied to Jmol 11.8 for this case, and there "count()" is not
> supported. "{*}.chain.size" gives the number of atoms, not useful.
>
"{*}.chain.count().size" looks more elegant but is much slower because
"{*}.chain" returns an individual result for each atom that must then be
processed by "count()". Jmol is so fast that you will only see a
difference with very large structures. But with JSmol you can actually
see the difference even with a rather small structure with about 9000
atoms on my system.
Regards,
Rolf
--
Rolf Huehne
Postdoc
Leibniz Institute for Age Research - Fritz Lipmann Institute (FLI)
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