[gmx-users] g_velacc problem

[Florian Dommert]

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On 10/14/2010 01:33 PM, Eudes Fileti wrote:
> Hi Florian, in fact I had already realized that it was possible 
> to calculate the VACF without using the -m option (although this option 
> was important for my calculations).
> 
> I have not received any attachment, have you send me something? 
> If necessary, please, send it to my email.
> 
> Following your suggestions I changed the indicated lines and recompiled
> the program. 

Berk fixed the problem in the git. So the fix will be included in the
next release and is already contained in the git release-branch I
assume. The attached file just contained a patch for the git but you do
not need it.

/Flo

> Now I gotta get VACF! It's working fine even including the -m flag.
> 
> Thank you.
> eef
> 
> _______________________________________
> Eudes Eterno Fileti
> Física da Matéria Condensada
> Simulação Computacional de Nano-estruturas via Dinâmica Molecular
> 
> 


- -- 
Florian Dommert
Dipl.-Phys.

Institute for Computational Physics

University Stuttgart

Pfaffenwaldring 27
70569 Stuttgart

Phone: +49(0)711/685-6-3613
Fax:   +49-(0)711/685-6-3658

EMail: dommert at icp.uni-stuttgart.de
Home: http://www.icp.uni-stuttgart.de/~icp/Florian_Dommert
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