(Q46196442)

20 December 2017

title

Using AutoDock for ligand-receptor docking (English)

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20 December 2017

Garrett M Morris

1

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author name string

Ruth Huey

series ordinal

2

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20 December 2017

Arthur J Olson

series ordinal

3

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20 December 2017

publication date

1 December 2008

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20 December 2017

Current Protocols in Bioinformatics

published in

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20 December 2017

volume

Chapter 8

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20 December 2017

page(s)

Unit 8.14

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20 December 2017

cites work

The Protein Data Bank

1 reference

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Comparing protein-ligand docking programs is difficult.

21 January 2018

1 reference

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Target flexibility: an emerging consideration in drug discovery and design

21 January 2018

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A new model for calculating atomic charges in molecules

21 January 2018

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Automated docking of substrates to proteins by simulated annealing

21 January 2018

1 reference

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Efficient docking of peptides to proteins without prior knowledge of the binding site

21 January 2018

1 reference

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Blind docking of drug-sized compounds to proteins with up to a thousand residues

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F0471250953.BI0814S24

A semiempirical free energy force field with charge-based desolvation

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F0471250953.BI0814S24

Evaluation of docking performance: comparative data on docking algorithms

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F0471250953.BI0814S24

Theoretical and practical considerations in virtual screening: a beaten field?

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F0471250953.BI0814S24

Prediction of protein-ligand interactions. Docking and scoring: successes and gaps

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F0471250953.BI0814S24

Computational drug design accommodating receptor flexibility: the relaxed complex scheme

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F0471250953.BI0814S24

The relaxed complex method: Accommodating receptor flexibility for drug design with an improved scoring scheme

21 January 2018

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Discovery of a novel binding trench in HIV integrase.

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F0471250953.BI0814S24

Lead discovery using molecular docking

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F0471250953.BI0814S24

Protein-ligand docking: current status and future challenges

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F0471250953.BI0814S24

BDT: an easy-to-use front-end application for automation of massive docking tasks and complex docking strategies with AutoDock

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F0471250953.BI0814S24

A critical assessment of docking programs and scoring functions

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F0471250953.BI0814S24

Distributed automated docking of flexible ligands to proteins: Parallel applications of AutoDock 2.4

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F0471250953.BI0814S24

10.1002/0471250953.BI0814S24

21 January 2018

Identifiers

DOI

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20 December 2017

1 reference

20 December 2017