(Q34490693)

2 August 2017

title

Limits of ligand selectivity from docking to models: in silico screening for A(1) adenosine receptor antagonists (English)

1 reference

2 August 2017

1 reference

5

Andrej Sali

0 references

Peter Kolb

object named as

Peter Kolb

1

0 references

Kenneth A. Jacobson

object named as

Kenneth A Jacobson

6

0 references

Zhan-Guo Gao

3

object named as

Zhan-Guo Gao

1 reference

2 August 2017

Khai Phan

2

1 reference

2 August 2017

Adam C Marko

4

1 reference

2 August 2017

language of work or name

English

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publication date

21 November 2012

1 reference

2 August 2017

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2 August 2017

volume

7

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2 August 2017

issue

11

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2 August 2017

page(s)

e49910

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Creative Commons CC0 License

2 August 2017

copyright license

start time

21 November 2012

1 reference

April 2022 Public Data File from Crossref

copyright status

copyrighted, dedicated to the public domain by copyright holder

0 references

cites work

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Ligand-Steered Modeling and Docking: A Benchmarking Study in Class A G-Protein-Coupled Receptors

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6 July 2018

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The 2.6 angstrom crystal structure of a human A2A adenosine receptor bound to an antagonist

6 July 2018

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QSAR study on a novel series of 8-azaadenine analogues proposed as A1 adenosine receptor antagonists

6 July 2018

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6 July 2018

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6 July 2018

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6 July 2018

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6 July 2018

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6 July 2018

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6 July 2018

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6 July 2018

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6 July 2018

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6 July 2018

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6 July 2018

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21 January 2018

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Synthesis, biological activity, and molecular modeling investigation of new pyrazolo[4,3-e]-1,2,4-triazolo[1,5-c]pyrimidine derivatives as human A(3) adenosine receptor antagonists

21 January 2018

1 reference

https://api.crossref.org/works/10.1371%2FJOURNAL.PONE.0049910

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21 January 2018

1 reference

https://api.crossref.org/works/10.1371%2FJOURNAL.PONE.0049910

Matching chemistry and shape in molecular docking

21 January 2018

1 reference

https://api.crossref.org/works/10.1371%2FJOURNAL.PONE.0049910

Ligand solvation in molecular docking.

21 January 2018

1 reference

https://api.crossref.org/works/10.1371%2FJOURNAL.PONE.0049910

Use of the X-ray structure of the beta2-adrenergic receptor for drug discovery. Part 2: Identification of active compounds

21 January 2018

1 reference

https://api.crossref.org/works/10.1371%2FJOURNAL.PONE.0049910

Force Field Validation Using Protein Side Chain Prediction

21 January 2018

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https://api.crossref.org/works/10.1371%2FJOURNAL.PONE.0049910

Rolofylline: a selective adenosine 1 receptor antagonist for the treatment of heart failure

21 January 2018

1 reference

PubMed

https://pubmed.ncbi.nlm.nih.gov/23185482

inferred from PubMed ID database lookup

12 December 2020

based on heuristic

The Golden Age of GPCR Structural Biology: Any Impact on Drug Design?

1 reference

PubMed

https://pubmed.ncbi.nlm.nih.gov/23185482

inferred from PubMed ID database lookup

12 December 2020

based on heuristic

Identifiers

DOI

10.1371/JOURNAL.PONE.0049910

1 reference

2 August 2017

0 references

1 reference

2 August 2017

1 reference