ADL: about prepare_dpf4_flex.py

Shultz, Jack JShultz at nas.edu
Wed Jan 30 06:12:06 PST 2008


Privet,

Funny, I'm looking in that same folder for my install and don't see it. Maybe someone at your university created a customized MGL python script? Are you trying to deduce how this script functions? I could try figuring it out if you send it on the list.

Jack

-----Original Message-----
From: autodock-bounces at scripps.edu [mailto:autodock-bounces at scripps.edu] On Behalf Of ?????????? ?????????
Sent: Wednesday, January 30, 2008 1:00 AM
To: autodock at scripps.edu
Subject: ADL: about prepare_dpf4_flex.py

Good day, Garrett, Ruth and all!

I am student of Siberian State Medical University (Tomsk, Russia). We use AutoDock for docking ligands to EGFR. To prepare many .dpf files we need script called prepare_dpf4_flex.py, but we haven't it in our folder ~/MGLTools-1.4.5/MGLToolsPckgs/AutoDockTools/Utilities24
We can't find it on http://autodock.scripps.edu/faqs-help/faq/where-can-i-find-the-python-scripts-for-preparing-and-analysing-autodock-dockings
,too.

Please help us -- tell, where we can get this script.

Constantin Goremykin.
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