Spring DR - Search Results

1

The use of chlorobenzene as a probe molecule in molecular dynamics simulations.

Tan YS, Spring DR, Abell C, Verma C. Tan YS, et al. Among authors: spring dr. J Chem Inf Model. 2014 Jul 28;54(7):1821-7. doi: 10.1021/ci500215x. Epub 2014 Jun 18. J Chem Inf Model. 2014. PMID: 24910248

2

Controlling the contents of microdroplets by exploiting the permeability of PDMS.

Shim JU, Patil SN, Hodgkinson JT, Bowden SD, Spring DR, Welch M, Huck WT, Hollfelder F, Abell C. Shim JU, et al. Among authors: spring dr. Lab Chip. 2011 Mar 21;11(6):1132-7. doi: 10.1039/c0lc00615g. Epub 2011 Feb 7. Lab Chip. 2011. PMID: 21298160 Free article.

3

Synthesis and biological profiling of tellimagrandin I and analogues reveals that the medium ring can significantly modulate biological activity.

Zheng S, Laraia L, O' Connor CJ, Sorrell D, Tan YS, Xu Z, Venkitaraman AR, Wu W, Spring DR. Zheng S, et al. Among authors: spring dr. Org Biomol Chem. 2012 Apr 7;10(13):2590-3. doi: 10.1039/c2ob25065a. Epub 2012 Feb 23. Org Biomol Chem. 2012. PMID: 22361895

4

Using ligand-mapping simulations to design a ligand selectively targeting a cryptic surface pocket of polo-like kinase 1.

Tan YS, Śledź P, Lang S, Stubbs CJ, Spring DR, Abell C, Best RB. Tan YS, et al. Among authors: spring dr. Angew Chem Int Ed Engl. 2012 Oct 1;51(40):10078-81. doi: 10.1002/anie.201205676. Epub 2012 Sep 7. Angew Chem Int Ed Engl. 2012. PMID: 22961729 Free PMC article. No abstract available.

5

A strategy for the diversity-oriented synthesis of macrocyclic scaffolds using multidimensional coupling.

Beckmann HS, Nie F, Hagerman CE, Johansson H, Tan YS, Wilcke D, Spring DR. Beckmann HS, et al. Among authors: spring dr. Nat Chem. 2013 Oct;5(10):861-7. doi: 10.1038/nchem.1729. Epub 2013 Aug 25. Nat Chem. 2013. PMID: 24056343

6

How diverse are diversity assessment methods? A comparative analysis and benchmarking of molecular descriptor space.

Koutsoukas A, Paricharak S, Galloway WR, Spring DR, Ijzerman AP, Glen RC, Marcus D, Bender A. Koutsoukas A, et al. Among authors: spring dr. J Chem Inf Model. 2014 Jan 27;54(1):230-42. doi: 10.1021/ci400469u. Epub 2013 Dec 13. J Chem Inf Model. 2014. PMID: 24289493

7

Diversity-oriented synthesis as a tool for identifying new modulators of mitosis.

Ibbeson BM, Laraia L, Alza E, O' Connor CJ, Tan YS, Davies HM, McKenzie G, Venkitaraman AR, Spring DR. Ibbeson BM, et al. Among authors: spring dr. Nat Commun. 2014;5:3155. doi: 10.1038/ncomms4155. Nat Commun. 2014. PMID: 24434687 Free article.

8

Investigating peptide sequence variations for 'double-click' stapled p53 peptides.

Lau YH, de Andrade P, Sköld N, McKenzie GJ, Venkitaraman AR, Verma C, Lane DP, Spring DR. Lau YH, et al. Among authors: spring dr. Org Biomol Chem. 2014 Jun 28;12(24):4074-7. doi: 10.1039/c4ob00742e. Org Biomol Chem. 2014. PMID: 24817343

9

A diversity-oriented synthesis strategy enabling the combinatorial-type variation of macrocyclic peptidomimetic scaffolds.

Isidro-Llobet A, Hadje Georgiou K, Galloway WR, Giacomini E, Hansen MR, Méndez-Abt G, Tan YS, Carro L, Sore HF, Spring DR. Isidro-Llobet A, et al. Among authors: spring dr. Org Biomol Chem. 2015 Apr 21;13(15):4570-80. doi: 10.1039/c5ob00371g. Org Biomol Chem. 2015. PMID: 25778821 Free PMC article.

10

The Application of Ligand-Mapping Molecular Dynamics Simulations to the Rational Design of Peptidic Modulators of Protein-Protein Interactions.

Tan YS, Spring DR, Abell C, Verma CS. Tan YS, et al. Among authors: spring dr. J Chem Theory Comput. 2015 Jul 14;11(7):3199-210. doi: 10.1021/ct5010577. Epub 2015 Jun 22. J Chem Theory Comput. 2015. PMID: 26575757

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