Townsend-Nicholson A - Search Results

1

The biological impact of blood pressure-associated genetic variants in the natriuretic peptide receptor C gene on human vascular smooth muscle.

Ren M, Ng FL, Warren HR, Witkowska K, Baron M, Jia Z, Cabrera C, Zhang R, Mifsud B, Munroe PB, Xiao Q, Townsend-Nicholson A, Hobbs AJ, Ye S, Caulfield MJ. Ren M, et al. Hum Mol Genet. 2018 Jan 1;27(1):199-210. doi: 10.1093/hmg/ddx375. Hum Mol Genet. 2018. PMID: 29040610 Free PMC article.

2

An Ensemble-Based Protocol for the Computational Prediction of Helix-Helix Interactions in G Protein-Coupled Receptors using Coarse-Grained Molecular Dynamics.

Altwaijry NA, Baron M, Wright DW, Coveney PV, Townsend-Nicholson A. Altwaijry NA, et al. J Chem Theory Comput. 2017 May 9;13(5):2254-2270. doi: 10.1021/acs.jctc.6b01246. Epub 2017 Apr 25. J Chem Theory Comput. 2017. PMID: 28383913 Free PMC article.

3

Towards Precision Oncology: The Role of Smoothened and Its Variants in Cancer.

Nicheperovich A, Townsend-Nicholson A. Nicheperovich A, et al. Among authors: townsend nicholson a. J Pers Med. 2022 Oct 5;12(10):1648. doi: 10.3390/jpm12101648. J Pers Med. 2022. PMID: 36294790 Free PMC article. Review.

4

Ensemble-Based Steered Molecular Dynamics Predicts Relative Residence Time of A_2A Receptor Binders.

Potterton A, Husseini FS, Southey MWY, Bodkin MJ, Heifetz A, Coveney PV, Townsend-Nicholson A. Potterton A, et al. J Chem Theory Comput. 2019 May 14;15(5):3316-3330. doi: 10.1021/acs.jctc.8b01270. Epub 2019 Apr 26. J Chem Theory Comput. 2019. PMID: 30893556 Free article.

5

Characterising GPCR-ligand interactions using a fragment molecular orbital-based approach.

Heifetz A, James T, Southey M, Morao I, Aldeghi M, Sarrat L, Fedorov DG, Bodkin MJ, Townsend-Nicholson A. Heifetz A, et al. Curr Opin Struct Biol. 2019 Apr;55:85-92. doi: 10.1016/j.sbi.2019.03.021. Epub 2019 Apr 22. Curr Opin Struct Biol. 2019. PMID: 31022570 Review.

6

Computational prediction of GPCR oligomerization.

Townsend-Nicholson A, Altwaijry N, Potterton A, Morao I, Heifetz A. Townsend-Nicholson A, et al. Curr Opin Struct Biol. 2019 Apr;55:178-184. doi: 10.1016/j.sbi.2019.04.005. Epub 2019 Jun 4. Curr Opin Struct Biol. 2019. PMID: 31170578 Review.

7

Characterizing Rhodopsin-Arrestin Interactions with the Fragment Molecular Orbital (FMO) Method.

Heifetz A, Townsend-Nicholson A. Heifetz A, et al. Methods Mol Biol. 2020;2114:177-186. doi: 10.1007/978-1-0716-0282-9_12. Methods Mol Biol. 2020. PMID: 32016894 Review.

8

Characterizing Interhelical Interactions of G-Protein Coupled Receptors with the Fragment Molecular Orbital Method.

Heifetz A, Morao I, Babu MM, James T, Southey MWY, Fedorov DG, Aldeghi M, Bodkin MJ, Townsend-Nicholson A. Heifetz A, et al. Among authors: townsend nicholson a. J Chem Theory Comput. 2020 Apr 14;16(4):2814-2824. doi: 10.1021/acs.jctc.9b01136. Epub 2020 Mar 9. J Chem Theory Comput. 2020. PMID: 32096994 Free PMC article.

9

Hit-to-lead and lead optimization binding free energy calculations for G protein-coupled receptors.

Wan S, Potterton A, Husseini FS, Wright DW, Heifetz A, Malawski M, Townsend-Nicholson A, Coveney PV. Wan S, et al. Among authors: townsend nicholson a. Interface Focus. 2020 Dec 6;10(6):20190128. doi: 10.1098/rsfs.2019.0128. Epub 2020 Oct 16. Interface Focus. 2020. PMID: 33178414 Free PMC article.

10

Rapid and accurate assessment of GPCR-ligand interactions Using the fragment molecular orbital-based density-functional tight-binding method.

Morao I, Fedorov DG, Robinson R, Southey M, Townsend-Nicholson A, Bodkin MJ, Heifetz A. Morao I, et al. J Comput Chem. 2017 Sep 5;38(23):1987-1990. doi: 10.1002/jcc.24850. Epub 2017 Jul 4. J Comput Chem. 2017. PMID: 28675443 Free PMC article.

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