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 Post subject: result but no docking on it
PostPosted: Tue Jul 20, 2010 4:03 am 

Joined: Fri Apr 09, 2010 7:37 pm
Posts: 8
I have produced some dockings showing more than one result. However the second or third result show the protein only and no ligand. For reference see in folder 2J5M, the docking DBT to 2j5m. The second result is a typical example of what I mean.
lola


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 Post subject: Re: result but no docking on it
PostPosted: Tue Jul 20, 2010 2:17 pm 

Joined: Wed Oct 29, 2008 2:24 pm
Posts: 197
Thank you for reporting this issue, we are investigating it.
Zsolt


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 Post subject: Re: result but no docking on it
PostPosted: Tue Jul 20, 2010 8:26 pm 

Joined: Wed Oct 29, 2008 2:24 pm
Posts: 197
Dear Lola,

we were not able to reproduce the error, it worked fine for us. A new button was put into your account - it is called "Restart: Make results table" and you can find it under the Energy tab of docking results. If this happens again that there is no molecule in the lower ranked results, please click on this button, which will resolve your problem - we have corrected "DBT to 2j5m" in the same way.

Kind Regards,
Zsolt

Loadeanda wrote:
I have produced some dockings showing more than one result. However the second or third result show the protein only and no ligand. For reference see in folder 2J5M, the docking DBT to 2j5m. The second result is a typical example of what I mean.
lola


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 Post subject: Re: result but no docking on it
PostPosted: Tue Jul 20, 2010 8:59 pm 

Joined: Fri Apr 09, 2010 7:37 pm
Posts: 8
Dear Zsolt,

Thank you. I'm restarting all the stalled results to see if it works (it worked fine for DBT to 2j5m).

Regards
Lola


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