ADL: Can´t choose ligand in autodocktools

Leo Juhlin leojuhlin at gmail.com
Mon Apr 13 05:44:36 PDT 2020


Thank you for your answer!

Den mån 13 apr. 2020 kl 10:31 skrev Muzaffar Rehman <m.muzaffar687 at gmail.com
>:

> Check the folder name which has ligand, protein and the exe files for
> spaces. If the folder names has space, *For example: "New folder", then
> *rename
> it to: *"NewFolder"*
>
> Then perform the docking from the beginning. You wont get such error.
>
> On Mon, 13 Apr 2020 at 12:56, Leo Juhlin <leojuhlin at gmail.com> wrote:
>
> > Whenever I use autodocktools and go to "grid--->set map types----> choose
> > ligand and select u´ligand´ I get the error message:
> > "Exception in Tkinter callback
> > Traceback (most recent call last):
> >   File "C:\Program Files (x86)\MGLTools-1.5.6\lib\lib-tk\Tkinter.py",
> line
> > 1403, in __call__
> >     return self.func(*args)
> >   File "C:\Program Files
> > (x86)\MGLTools-1.5.6\lib\site-packages\AutoDockTools\autogpfCommands.py",
> > line 4618, in chooseLigand_cb
> >     mol = self.chooser.getMolSet()
> >   File "C:\Program Files
> > (x86)\MGLTools-1.5.6\lib\site-packages\Pmv\guiTools.py", line 178, in
> > getMolSet
> >     if self.mode=='single': return mols[0]
> >   File "C:\Program Files (x86)\MGLTools-1.5.6\lib\UserList.py", line 28,
> in
> > __getitem__
> >     def __getitem__(self, i): return self.data[i]
> > IndexError: list index out of range"
> >
> > Can someone please help me fix this?
> >
> > Best regards, Leo
> > ________________________________________________
> > --- ADL: AutoDock List  --- http://autodock.scripps.edu/mailing_list ---
> ________________________________________________
> --- ADL: AutoDock List  --- http://autodock.scripps.edu/mailing_list ---



-- 

*              Leo Juhlin*
              LeoJuhlin at gmail.com / 706506448


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