ABCC : Application's document Page

AutoDock At ABCC
Name: 
AutoDock
Version(s): 
3.0.5
Category: 
Molecular Modeling; Other
Author(s)/Vendor(s): 
Garret M. Morris, David S. Goodsell, Ruth Huey, 
William E. Hart, Scott Halliday, Rik Belew, Arthur J. Olson
Program Description: 
AutoDock is a suite of programs developed to study how small molecules 
such as drug molecules bind to a receptor of known 3D-structure. 
Please also see the application AutoDockTools (ADT) which has been 
specifically developed as a GUI for AutoDock. 

Please cite the following reference(s) with the AutoDock results 

Morris, G.M., Goodsell. D.S., Halliday, R.S., 
Huey, R., Hart, W.E., Belew, R.K., and Olson, A.J. (1998) J. Computational 
Chemistry, 19: 1639-1662.  'Automated Docking Using a Lamarckian Genetic 
Algorithm and an Empirical Binding Free Energy Function".
Computer platform(s): 
SGI  Irix
Linux
Location: 
/usr/local/fbscapp/autodockroot
Access: 
setenv ADHOM /usr/local/fbscapp/autodockroot

set path = ($path
$ADHOM/dist305/bin $ADHOM/dist305/share )

Then type: 

autotors //to start AutoTors
autogrid3 // to start autogrid
autodock3 // to start AutoDock3
Documentation: 
/usr/local/fbscapp/autodockroot/doc/AutoDock3.0.5_UserGuide.ps
Web Site: 
http://www.scripps.edu/mb/olson/doc/autodock/
ABCC Contact Person:
Created By: 
ravichas
Created Time: 
2002-04-02
Updated By: 
ravichas
Updated Time: 
2002-04-12
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