A benchmarking study on virtual ligand screening against homology models of human GPCRs-Reference-Cited by-同舟云学术

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A benchmarking study on virtual ligand screening against homology models of human GPCRs

Published:2018-09 Issue:9 Volume:86 Page:978-989
ISSN:0887-3585
Container-title:Proteins: Structure, Function, and Bioinformatics
language:en
Short-container-title:Proteins

Author:

Lim Victor Jun Yu¹²,Du Weina¹,Chen Yu Zong³,Fan Hao¹⁴⁵^ORCID

Affiliation:

1. Bioinformatics Institute (BII), Agency for Science; Technology and Research (A*STAR); Singapore 138671

2. Saw Swee Hock School of Public Health; National University of Singapore; Singapore 117549

3. Department of Pharmacy; National University of Singapore; Singapore 117543

4. Department of Biological Sciences; National University of Singapore; Singapore 117558

5. Center for Computational Biology; Duke-NUS Medical School; Singapore 169857

Publisher

Wiley

Subject

Molecular Biology,Biochemistry,Structural Biology

Link

http://onlinelibrary.wiley.com/wol1/doi/10.1002/prot.25533/fullpdf

Reference44 articles.

1. The structure and function of G-protein-coupled receptors;Rosenbaum;Nature,2009

2. How many drug targets are there?;Overington;Nat Rev Drug Discov.,2006

3. The identification of high-affinity G protein-coupled receptor ligands from large combinatorial libraries using multicolor quantum dot-labeled cell-based screening;Fu;Future Med Chem,2014

4. Identification of novel adenosine A2A receptor antagonists by virtual screening;Langmead;J Med Chem,2012

5. Structure-based discovery of selective serotonin 5-HT1B receptor Ligands;Rodríguez;Structure,2014

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1. Comprehensive Survey of Consensus Docking for High-Throughput Virtual Screening;Molecules;2022-12-25

2. Designing drugs when there is low data availability: one-shot learning and other approaches to face the issues of a long-term concern;Expert Opinion on Drug Discovery;2022-08-30

3. Recent Advances in Structure, Function, and Pharmacology of Class A Lipid GPCRs: Opportunities and Challenges for Drug Discovery;Pharmaceuticals;2021-12-22

4. Machine Learning Assisted Approach for Finding Novel High Activity Agonists of Human Ectopic Olfactory Receptors;International Journal of Molecular Sciences;2021-10-26

5. Structure-Based Virtual Screening for Ligands of G Protein–Coupled Receptors: What Can Molecular Docking Do for You?;Pharmacological Reviews;2021-10

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