[gmx-users] problem

Terry terrencesun at gmail.com
Fri May 11 15:59:30 CEST 2012


You should paste your topology for you metal halides so that others can
help.



On Fri, May 11, 2012 at 9:48 PM, Anik Sen <aniksen at csmcri.org> wrote:

>  Hi, Am Anik Sen. AM using GROMACS 3.3.2 for one of my work.
>
>           I was trying to run the dynamics for some inorganic metal
> halides solvation in water. A fatal error is comingthat:
>
>    - Atomtype "CH2r" not found.
>
> But in my system I have no such atoms. Only water molecules with tip4p
> model and the inorganic metal halides. So please can anyone state whats the
> problem.
>
> Thanking in advance
> Anik Sen
>  ========================================================
> Anik Sen
> Student
> CSIR-Central Salt & Marine Chemicals Research Institute,
> Gijubhai Badheka Marg.
> Bhavnagar, Gujarat 364002
> [image: www.csmcri.org]
> ========================================================
>
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