Thanks Marius
With the second it works
A bientot
Stephane
-Message d'origine-
De : Marius Retegan [mailto:marius.s.rete...@gmail.com]
Envoyé : jeudi 22 septembre 2011 18:02
À : intra\sa175950
Objet : Re: [PyMOL] Write in a file the number of water at a distance from a
Hi Stephane,
you can select those waters using the "within" or "gap" selection
operators. "within" measures from the atom centre, whereas "gap" takes
the VDW radius into accout but selects everything beyond instead of
near. Have a look at those examples:
# use '... within ...'
select firstshel
