Re: [votca] Simplex State not Updating

[nabil . s . ramlawi]

Thanks!

Nabil

On Monday, September 25, 2017 at 11:52:59 AM UTC-5, Christoph Junghans 
wrote:
>
> 2017-09-25 9:48 GMT-06:00  : 
> > Hello all, 
> > 
> > I want to use simplex optimizer. I started by trying to run the tutorial 
> > file as a start. Nevertheless while running that example, the simplex 
> state 
> > is not updating after step 7 because the downhill processor script is 
> giving 
> > an error. From skimming through the inverse.log file, my guess is that 
> the 
> > function get_convergence_value defined in CsgSimplex is failing to give 
> the 
> > convergence value. 
> > I tried to change the initial parameter set in CG-CG.simplex.in but it 
> still 
> > did not work. 
> Fixed: 
> https://github.com/votca/csg/commit/ae71293febcbd4f03bd64b576a2933c46b007f83 
>
> Christoph 
> > 
> > Your feedback is appreciated. 
> > 
> > Thanks, 
> > Nabil 
> > 
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>
>
>
> -- 
> Christoph Junghans 
> Web: http://www.compphys.de 
>

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Re: [votca] Simplex State not Updating

[Christoph Junghans]

2017-09-25 9:48 GMT-06:00  :
> Hello all,
>
> I want to use simplex optimizer. I started by trying to run the tutorial
> file as a start. Nevertheless while running that example, the simplex state
> is not updating after step 7 because the downhill processor script is giving
> an error. From skimming through the inverse.log file, my guess is that the
> function get_convergence_value defined in CsgSimplex is failing to give the
> convergence value.
> I tried to change the initial parameter set in CG-CG.simplex.in but it still
> did not work.
Fixed: 
https://github.com/votca/csg/commit/ae71293febcbd4f03bd64b576a2933c46b007f83

Christoph
>
> Your feedback is appreciated.
>
> Thanks,
> Nabil
>
> --
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-- 
Christoph Junghans
Web: http://www.compphys.de

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