AutoDock

AutoDock is a molecular modeling simulation software. It is especially effective for protein-ligand docking. AutoDock 4 is available under the GNU… (More)
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Topic mentions per year

Topic mentions per year

1996-2018
0204019962018

Papers overview

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2011
2011
BACKGROUND Virtual (computational) screening is an increasingly important tool for drug discovery. AutoDock is a popular open… (More)
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Highly Cited
2010
Highly Cited
2010
AutoDock Vina, a new program for molecular docking and virtual screening, is presented. AutoDock Vina achieves an approximately… (More)
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Highly Cited
2010
Highly Cited
2010
Docking of small molecule compounds into the binding site of a receptor and estimating the binding affinity of the complex is an… (More)
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2010
2010
This paper is a report on the migration of the molecular docking application, “Autodock” to NVIDIA CUDA. Autodock… (More)
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Highly Cited
2009
Highly Cited
2009
BACKGROUND Molecular docking methods are commonly used for predicting binding modes and energies of ligands to proteins. For… (More)
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2008
2008
The molecular docking tools Autodock and Surflex accurately reproduce the crystallographic structures of a collection of small… (More)
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2007
2007
  • Chris Rosin
  • 2007
In this paper we evaluate the design of the hybrid EAs that are currently used to perform flexible ligand binding in the Autodock… (More)
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2007
2007
Molecular-docking-based virtual screening is an important tool in drug discovery that is used to significantly reduce the number… (More)
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Highly Cited
1998
Highly Cited
1998
A novel and robust automated docking method that predicts the bound conformations of flexible ligands to macromolecular targets… (More)
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Highly Cited
1996
Highly Cited
1996
AutoDock 2.4 predicts the bound conformations of a small, flexible ligand to a nonflexible macromolecular target of known… (More)
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