[gmx-users] Problem with size of trr file in Gromacs3
David van der Spoel
spoel at xray.bmc.uu.se
Thu Oct 25 14:27:29 CEST 2001
On Wed, 24 Oct 2001 sgaray at fbcb.unl.edu.ar wrote:
>My name is Sergio Garay, and I'm working with Gromacs 3.0
>compiled in my PC (PIII, two hard disk 20 a 30 GB, 512 Mb ram
>memory, and Red Hat 7.1). When my trr file is around 2 GB, the
>run is stoped with the follow message:
>The max file size is riched (or something like that)
>I had not this problem with gromacs 2.0.
>The working directory has not quotas.
This is a linux problem. You can not make files larger than 2 Gb.
The solution is to use xtc files (3 times smaller than trr files), and cut
your run into shorter pieces
Dr. David van der Spoel, Biomedical center, Dept. of Biochemistry
Husargatan 3, Box 576, 75123 Uppsala, Sweden
phone: 46 18 471 4205 fax: 46 18 511 755
spoel at xray.bmc.uu.se spoel at gromacs.org http://zorn.bmc.uu.se/~spoel
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