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Re: [ESPResSo-users] Coloring in VMD


From: Axel Arnold
Subject: Re: [ESPResSo-users] Coloring in VMD
Date: Sun, 25 May 2014 20:34:02 +0200
User-agent: Mozilla/5.0 (Macintosh; Intel Mac OS X 10.9; rv:24.0) Gecko/20100101 Thunderbird/24.5.0

On 25.05.14 12:27, Olaf Lenz wrote:
> If you do have charged atoms, you either have to use the current development code, or you have to
> modify the code of "prepare_vmd_connection" in scripts/auxiliary.tcl".

Actually, you don't. The prepare_vmd_connection passes any options that it doesn't know to the writevsf command, see the UG.

Just to repeat myself a third time:
... use the workaround option "ignore_charges" to prepare_vmd_connection.

Axel

--
JP Dr. Axel Arnold
ICP, Universit├Ąt Stuttgart
Allmandring 3
70569 Stuttgart, Germany
Email: address@hidden
Tel: +49 711 685 67609




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