VMD-L Mailing List

From: Olaf Lenz (olenz_at_fias.uni-frankfurt.de)
Date: Thu Apr 17 2008 - 05:19:52 CDT

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>> why so complicated?
>
>> shouldn't:
>
>> pbc wrap -center "<selection text for molecule>" -all
>
>> do the trick, provided there is only one molecule?

Doh, you're absolutely right. I thought you wanted to measure the hbonds
between all water molecules...

However, youre method only works, when the molecule does not stretch the
whole box.

Olaf
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