(Q43825573)

27 November 2017

Automated docking to multiple target structures: incorporation of protein mobility and structural water heterogeneity in AutoDock (English)

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27 November 2017

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Garrett M Morris

2

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David Goodsell

series ordinal

5

object named as

David S Goodsell

1 reference

27 November 2017

Fredrik Osterberg

1

1 reference

27 November 2017

Michel F Sanner

series ordinal

3

1 reference

27 November 2017

Arthur J Olson

series ordinal

4

1 reference

27 November 2017

language of work or name

English

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publication date

1 January 2002

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27 November 2017

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27 November 2017

46

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27 November 2017

34-40

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27 November 2017

1

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Flexible docking and design.

27 November 2017

1 reference

https://api.crossref.org/works/10.1002%2FPROT.10028

Side-chain flexibility in proteins upon ligand binding.

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2FPROT.10028

Ligand docking to proteins with discrete side-chain flexibility.

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2FPROT.10028

Molecular recognition of receptor sites using a genetic algorithm with a description of desolvation

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2FPROT.10028

Predicting structural effects in HIV-1 protease mutant complexes with flexible ligand docking and protein side-chain optimization

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2FPROT.10028

Molecular docking to ensembles of protein structures

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2FPROT.10028

Inhibitors of HIV-1 protease: a major success of structure-assisted drug design

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2FPROT.10028

Targeting the HIV-protease in AIDS therapy: a current clinical perspective

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2FPROT.10028

Iterative partial equalization of orbital electronegativity—a rapid access to atomic charges

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2FPROT.10028

Evaluation of the FLEXX incremental construction algorithm for protein-ligand docking

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2FPROT.10028

The sensitivity of the results of molecular docking to induced fit effects: application to thrombin, thermolysin and neuraminidase

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2FPROT.10028

Automated docking using a Lamarckian genetic algorithm and an empirical binding free energy function

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2FPROT.10028

21 January 2018

Identifiers

DOI

10.1002/PROT.10028

1 reference

27 November 2017

1 reference