[ase-users] Function delete atoms within a certain distance

[Daria Tombolelli]

Hi all,
ASE users.

Is there an already implemented function that greps atoms within a certain
distance from other atoms?

To explain: I have an equilibrated water box and want to insert a molecule
in it and delete the water molecules that happen to be within 2Ang from any
atom of the molecule.

I wrote myself a function of course but I was wondering if there might be
already a function implemented that I have been able to find.

Best regards,
Daria Tombolelli
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://listserv.fysik.dtu.dk/pipermail/ase-users/attachments/20191118/b78d09f1/attachment.html>