[gmx-users] (no subject)

David van der Spoel spoel at xray.bmc.uu.se
Mon Apr 10 12:45:01 CEST 2006

caterina merla wrote:
> Hallo to all
> I try to use the function g_dielectric but it does not work , before I 
> use the function g_dipoles to create the ACF of the all system it is the 
> dipcorr.xvg and I put it as the input  file for the g_dielectric  but I 
> obtained a message of error, I 'd like to know which is the correct file 
> format or input file that I have to give to the g_dielectric to get 
> results. (I try with the exmple of methanol and peptide in the gromacs 
> share directory).
> Thank you Caterina
please submit a bugzilla and upload the ACF and the command line to 
reproduce the problem.

David van der Spoel, PhD, Assoc. Prof., Molecular Biophysics group,
Dept. of Cell and Molecular Biology, Uppsala University.
Husargatan 3, Box 596,  	75124 Uppsala, Sweden
phone:	46 18 471 4205		fax: 46 18 511 755
spoel at xray.bmc.uu.se	spoel at gromacs.org   http://folding.bmc.uu.se

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