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AutoDock4.2.6

by Ruth Huey — 2014-08-04 11:53

AutoDock4.2.6 features improved input checking and an output format suitable for automated analysis.

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AutoDock4.2.5.1

by Ruth Huey — 2013-01-03 13:46

New AutoDock version fixes bug in version 4.2.5

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Tutorial section has been updated

by Stefano Forli — 2010-02-25 14:42

The tutorial section has been updated.

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Print Your Favorite Molecule!

by Sargis Dallakyan — 2009-12-16 13:51

3D Molecular Model Printing Service from Our Lab

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AutoDock's role in Developing the First Clinically-Approved HIV Integrase Inhibitor

by morris — 2007-12-17 18:18

Prof. J. Andrew McCammon and his colleagues used AutoDock and the Relaxed Complex Method to discover discover novel modes of inhibition of HIV integrase. Researchers at Merck Pharmaceutical Company have used McCammon's work to design new drugs that target integrase, which lead in October 2007 to the first clinically-approved HIV Integrase inhibitor: Isentress™ (raltegravir).

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RELEASE of AutoDock 4 under GPL

by gillet — 2007-05-08 14:44

AutoDock 4 is NOW AVAILABLE under GPL

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AutoDock 4 will be distributed under the Gnu GPL

by morris — 2007-05-04 10:44

A message from Prof. Arthur J. Olson.

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Successfully Docking to Proteins with Metal Ions

by morris — 2007-05-04 10:45

Many enzyme targets have metal ions in their active sites that play key roles in substrate binding and catalysis. A recent paper in Proteins investigated how AutoDock performed in docking to a variety of adenylyl cyclase toxins, with Mg2+ and Zn2+ ions in their active sites. Getting the right protonation state on the ligands and the right charges on the metal are key to success.

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AutoDock is the most cited docking software

AutoDock is the most cited docking software

by morris — 2007-05-04 10:44

A recent publication in Proteins compared the number of citations of 22 different docking programs using the ISI Web of Science; AutoDock was the most cited, and its share of the top 5 docking programs' citations has increased over the period from 2001 to 2005, from 36% to 48%.

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AutoDock 4 Beta Release

by gillet — 2006-09-27 16:22

Release Note for AutoDock 4

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AutoDock 4 Powers FightAIDS@Home

by morris — 2006-02-09 19:12

AutoDock 4 has now been used since November 2005 on the World Community Grid to perform quadrillions of energy evaluations in the search for novel HIV protease inhibitors.

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FightAIDS@Home and World Community Grid

by admin — 2005-10-12 16:59

FightAIDS@Home and World Community Grid

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AccelrysWorld2005

by admin — 2005-10-12 16:52

AccelrysWorld 2005, London, UK

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[···] by gillet — last modified 2006-09-27 16:01
 

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