[gmx-users] DSSP

Mark Abraham mark.j.abraham at gmail.com
Mon Aug 25 14:53:07 CEST 2014


Have you read and followed gmx do_dssp -h?

Mark


On Mon, Aug 25, 2014 at 2:21 PM, Nikolaos Michelarakis <nm884 at york.ac.uk>
wrote:

> Hello,
>
> Thank you all for your help! I got it working by downloading the
> executables directly and setting the path but i do get the
>
> Program do_dssp, VERSION 5.0
> Source code file:
>
> /home/jslatter/programs/gromacs/gromacs-5.0/src/gromacs/gmxana/gmx_do_dssp.c,
> line: 670
>
> Fatal error:
> Failed to execute command: Try specifying your dssp version with the -ver
> option.
>
> error. No matter which version i specify, it persists, any ideas?
>
> Cheers,
>
> Nicholas
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