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Re: [modeller_usage] set restraints violations directory
- To: Antoine Leimgruber <antoine.leimgruber AT etu.unil.ch>
- Subject: Re: [modeller_usage] set restraints violations directory
- From: Modeller Caretaker <modeller-care@ucsf.edu>
- Date: Fri, 9 Jan 2004 12:50:13 -0800
- Cc: modeller_usage@listsrv.ucsf.edu
On Fri, Jan 09, 2004 at 06:34:14PM +0100, Antoine Leimgruber wrote:
> I use this kind of commands in my top files.
>
> SET DIRECTORY = 'path_to_topfile'
> SET ATOM_FILES_DIRECTORY = 'path_to_topfile'
> SET OUTPUT_DIRECTORY = 'path_to_topfile'
>
> However, all the *.V* files are generated in the directory where the
> perl script launching modeller is and not in the directory where the
> top file actually is.
> What is the equivalent for these files ?
Unfortunately, all energy profiles (including violations) get written to
the current directory, ignoring OUTPUT_DIRECTORY, so there's nothing you
can do about this other than try to work around it. This is a bug in
Modeller, which will be fixed in the next release.
Ben Webb, Modeller Caretaker
--
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