
AutoDock
AutoDock is a suite of automated docking tools. It is designed to predict how small molecules, such as substrates or drug candidates, bind to a receptor of known 3D structure.
Download AutoDock4 – AutoDock
This page provides the downloads for the stable AutoDock4 version (v4.2.6) but we encourage users to use the newer version AutoDock GPU, which includes many bug fixes and new features.
Resources – AutoDock
Raccoon v1.0 (AutoDock4) & Raccoon v2.0 (AutoDock Vina) – graphical user interfaces to prepare and submit docking jobs with AutoDock4 and AutoDock Vina. Target analysis and pocket predictions
Downloads – AutoDock
Downloads Title Downloads content OS Files Installation instructions Docking_tool.v.1.0.tar.gz See instructions Linux Docking_tool.v.1.0.tar.gz (OS X 11) Docking_tool.v.1.0.tar.gz (OS X 12) See …
Documentation – AutoDock
User manuals AutoDock 3.0.5 User Guide (PDF) AutoDock 4.2.6 User Guide (PDF) Frequently-Asked-Questions (FAQ) How to add new atom types to the AutoDock force field
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AutoDock Version 4.2
Jul 28, 2014 · AutoDock is an automated procedure for predicting the interaction of ligands with biomacromolecular targets. The motivation for this work arises from problems in the design of …
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AutoDock
The program AutoDock was developed to provide an automated procedure for predicting the interaction of ligands with biomacromolecular targets. The motivation for this work arises from problems in the …
Covalent Docking – AutoDock
Covalent docking using autodock: Two-point attractor and flexible side chain methods, Bianco, G., Forli, Forli, S., Goodsell, D., S., Olson, A., J. Protein Science.
AutoDock Zn – AutoDock
The AutoDockZN extended the AutoDock force field to include a specialized potential describing the interactions of zinc-coordinating ligands. This potential describes both the energetic and geometric …
How to add new atom types to the AutoDock force field
Finally, you will need to direct AutoGrid and AutoDock to use the modified atomic parameter file instead of the default values included internally in the programs.