[gmx-users] (no subject)

[David van der Spoel]

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.
________________________________________________________________________
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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