[gmx-users] Re: [gmx-developers] My system stops in the middle of a minimization

Anton Feenstra k.a.feenstra at vu.nl
Mon Apr 22 10:37:09 CEST 2013


On 19/04/13 19:42, Vitor Fonseca wrote:
> Good Afternoon devs,
>
>
>
> When i try to make a minimization on my system ( hexane 216 molecules in
> a box of 5 5 5 size), It seems the system freezes and doesnt end the
> minimization up!
>
> The system tilts in this message
>
> checking input for internal consistency...
> processing topology...
> Generated 332520 of the 332520 non-bonded parameter combinations
> Generating 1-4 interactions: fudge = 0.5
> Generated 332520 of the 332520 1-4 parameter combinations
> Excluding 216 bonded neighbours molecule type 'PRO'
>
> Could anyone help me?

Dear Vitor,

This sounds like a users question, please use the gmx-users list for 
that (included in this message already).

-- 
Groetjes,

Anton
  _____________ _______________________________________________________
|             |                                                       |
|  _   _  ___,| K. Anton Feenstra                                     |
| / \ / \'| | | IBIVU/Bioinformatics - Vrije Universiteit Amsterdam   |
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|             | Feenstra at few.vu.nl - www.few.vu.nl/~feenstra/         |
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