Hi try the below command. in your command you have _d in the editconf which is unnecessary. hope it works
editconf -f K2496T.gro -o boxx.gro -bt cubic -d 0.5 Regards Vinoth On Tue, Nov 9, 2010 at 11:28 AM, priyam saxena <[email protected]> wrote: > Hey everybody, > > Eveytime I use the editconf command, it gives an input/output error in form > of my output.gro file. > > This is the command i've used: > > editconf_d -f K2496T.gro -o boxx.gro -bt cubic -d 0.5 > > Following is the error generated: > > Read 7269 atoms > Volume: 972.45 nm^3, corresponds to roughly 437600 electrons > No velocities found > system size : 11.092 14.601 6.004 (nm) > diameter : 15.729 (nm) > center : 4.884 10.276 -1.814 (nm) > box vectors : 11.093 14.601 6.004 (nm) > box angles : 90.00 90.00 90.00 (degrees) > box volume : 972.45 (nm^3) > shift : 3.480 -1.911 10.179 (nm) > new center : 8.365 8.365 8.365 (nm) > new box vectors : 16.729 16.729 16.729 (nm) > new box angles : 90.00 90.00 90.00 (degrees) > new box volume :4681.89 (nm^3) > > Source code file: futil.c, line: 458 > > File input/output error: > boxx.gro > > I tried using different output file name and simply -o. but stil the error > remains. > > Please help! > > > -- > gmx-users mailing list [email protected] > http://lists.gromacs.org/mailman/listinfo/gmx-users > Please search the archive at > http://www.gromacs.org/Support/Mailing_Lists/Search before posting! > Please don't post (un)subscribe requests to the list. Use the > www interface or send it to [email protected]. > Can't post? Read http://www.gromacs.org/Support/Mailing_Lists >
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