[MMTK] PartitionedCollection.selectShell

Konrad Hinsen hinsen at cnrs-orleans.fr
Mon Jan 22 07:46:51 UTC 2007


On 19.01.2007, at 18:39, Chris MacRaild wrote:

> Shouldn't these procedures give the same set of atoms?

At first sight, yes, but there could always be some subtle  
differences elsewhere in the script. Could you please send/post a  
complete script that demonstrates this behaviour?

Konrad.
--
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Konrad Hinsen
Centre de Biophysique Moléculaire, CNRS Orléans
Synchrotron Soleil - Division Expériences
Saint Aubin - BP 48
91192 Gif sur Yvette Cedex, France
Tel. +33-1 69 35 97 15
E-Mail: hinsen at cnrs-orleans.fr
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