[gmx-users] Box dimensions variation

Yasser Almeida Hernández yasser.almeida.hernandez at chemie.uni-hamburg.de
Wed Aug 10 17:58:54 CEST 2016

Hi Tsjerk,

Thanks! You are right. I used Pcoupltype = semiisotropic, so I should 
change it to isotropic.



> Hi Yasser,
> Probably you're using semi-isotropic pressure coupling, which you should
> only do if you have a membrane like structure aligned with the XY plane (or
> a somewhat stiffish wire like structure aligned along z).
> Cheers,
> Tsjerk

Yasser Almeida Hernández
PhD student
Institute of Biochemistry and Molecular Biology
Department of Chemistry
University of Hamburg
Martin-Luther-King-Platz 6
20146 Hamburg
+49 40 42838 2845
yasser.almeida.hernandez at chemie.uni-hamburg.de
office: Grindelallee 117, room 250c

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