Thanks Angel and Rolf. The expression
{*}.atomIndex.max
is the one that I was trying to remember.
Otis
On 6/9/2010 8:50 AM, Rolf Huehne wrote:
> On 06/05/2010 02:23 PM, Angel Herráez wrote:
>
>> Otis,
>>
>>
>>> I might as well also ask you to remind me what the code is for the
>>> maximum atomIndex. I know that I should not be using the atomIndex=1000
>>> trick.
>>>
>> {*}.atomindex.all.size
>>
>>
> Deleted atoms will spoil the result of this command.
> Better use
>
> {*}.atomIndex.max
>
> Regards,
> Rolf
>
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--
Otis Rothenberger
chemagic.com
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