VMD-L Mailing List

From: david kastner (davidwkastner_at_gmail.com)
Date: Tue Oct 11 2016 - 22:42:49 CDT

Christopher Mayne,
Thank you for getting back so quickly! Moving the gaussian log files to a
directory without a space in the name worked perfectly. Thank you for
taking the time to interpret the error message for me.

Sincerely,
David Kastner

On Tue, Oct 11, 2016 at 7:51 AM, Mayne, Christopher G <cmayne2_at_illinois.edu>
wrote:

> David,
>
> I believe that this is due to the space in your path, specifically the
> "Google Drive” directory. I will dig into the code and add the appropriate
> protection for such file paths. In the meantime, however, the easiest work
> around is if you can, at least temporarily, move these files a directory
> that does not contain a space in the path.
>
> Regards,
> Christopher Mayne
>
>
>
> On Oct 10, 2016, at 10:52 PM, david kastner <davidwkastner_at_gmail.com>
> wrote:
>
> ffTK users,
> I successfully ran Dihedral Scan Inputs for ffTK Scan Torsions section on
> Gaussian and all jobs ended with a Normal Termination. However, when I try
> to use to Torsion Explorer to analyze the results I get the error message
> copied below. This appears when I "add" the dihedral scan log files and
> then try to "load" them. Any ideas would be very appreciated.
>
> *wrong # args:* should be "::ForceFieldToolKit::GenDihScan::TorExplor::readLog
> log"
> wrong # args: should be "::ForceFieldToolKit::GenDihScan::TorExplor::readLog
> log"
> while executing
> "::ForceFieldToolKit::GenDihScan::TorExplor::readLog
> C:/Users/david/Google Drive/Castle Lab/Beta-Hairpin
> Project/Conformers/YES/DHV_Awater/Param/5-dihO..."
> ("eval" body line 1)
> invoked from within
> "eval ::ForceFieldToolKit::GenDihScan::TorExplor::readLog $log"
> (procedure "::ForceFieldToolKit::GenDihScan::TorExplor::setup" line
> 23)
> invoked from within
> "::ForceFieldToolKit::GenDihScan::TorExplor::setup $loglist"
> invoked from within
> ".torexplor.hlf.inp.logbuttons.load invoke "
> invoked from within
> ".torexplor.hlf.inp.logbuttons.load instate {pressed !disabled} {
> .torexplor.hlf.inp.logbuttons.load state !pressed;
> .torexplor.hlf.inp.logbuttons.load..."
> (command bound to event)
>
> Sincerely,
> David Kastner
>
>
>
>