Dror RO - Search Results

1

Structural basis for modulation of a G-protein-coupled receptor by allosteric drugs.

Dror RO, Green HF, Valant C, Borhani DW, Valcourt JR, Pan AC, Arlow DH, Canals M, Lane JR, Rahmani R, Baell JB, Sexton PM, Christopoulos A, Shaw DE. Dror RO, et al. Nature. 2013 Nov 14;503(7475):295-9. doi: 10.1038/nature12595. Epub 2013 Oct 13. Nature. 2013. PMID: 24121438

2

Geometric Deep Learning for Structure-Based Ligand Design.

Powers AS, Yu HH, Suriana P, Koodli RV, Lu T, Paggi JM, Dror RO. Powers AS, et al. Among authors: dror ro. ACS Cent Sci. 2023 Nov 17;9(12):2257-2267. doi: 10.1021/acscentsci.3c00572. eCollection 2023 Dec 27. ACS Cent Sci. 2023. PMID: 38161364 Free PMC article.

3

CryoEM structures of the human CLC-2 voltage-gated chloride channel reveal a ball-and-chain gating mechanism.

Xu M, Neelands T, Powers AS, Liu Y, Miller SD, Pintilie GD, Bois JD, Dror RO, Chiu W, Maduke M. Xu M, et al. Among authors: dror ro. Elife. 2024 Feb 12;12:RP90648. doi: 10.7554/eLife.90648. Elife. 2024. PMID: 38345841 Free PMC article.

4

Protein model quality assessment using rotation-equivariant transformations on point clouds.

Eismann S, Suriana P, Jing B, Townshend RJL, Dror RO. Eismann S, et al. Among authors: dror ro. Proteins. 2023 Aug;91(8):1089-1096. doi: 10.1002/prot.26494. Epub 2023 May 9. Proteins. 2023. PMID: 37158708

5

Signaling Modulation Mediated by Ligand Water Interactions with the Sodium Site at μOR.

Ople RS, Ramos-Gonzalez N, Li Q, Sobecks BL, Aydin D, Powers AS, Faouzi A, Polacco BJ, Bernhard SM, Appourchaux K, Sribhashyam S, Eans SO, Tsai BA, Dror RO, Varga BR, Wang H, Hüttenhain R, McLaughlin JP, Majumdar S. Ople RS, et al. Among authors: dror ro. ACS Cent Sci. 2024 Jul 17;10(8):1490-1503. doi: 10.1021/acscentsci.4c00525. eCollection 2024 Aug 28. ACS Cent Sci. 2024. PMID: 39220695 Free PMC article.

6

Gaussian split Ewald: A fast Ewald mesh method for molecular simulation.

Shan Y, Klepeis JL, Eastwood MP, Dror RO, Shaw DE. Shan Y, et al. Among authors: dror ro. J Chem Phys. 2005 Feb 1;122(5):54101. doi: 10.1063/1.1839571. J Chem Phys. 2005. PMID: 15740304

7

The midpoint method for parallelization of particle simulations.

Bowers KJ, Dror RO, Shaw DE. Bowers KJ, et al. Among authors: dror ro. J Chem Phys. 2006 May 14;124(18):184109. doi: 10.1063/1.2191489. J Chem Phys. 2006. PMID: 16709099

8

Mechanism of Na+/H+ antiporting.

Arkin IT, Xu H, Jensen MØ, Arbely E, Bennett ER, Bowers KJ, Chow E, Dror RO, Eastwood MP, Flitman-Tene R, Gregersen BA, Klepeis JL, Kolossváry I, Shan Y, Shaw DE. Arkin IT, et al. Among authors: dror ro. Science. 2007 Aug 10;317(5839):799-803. doi: 10.1126/science.1142824. Science. 2007. PMID: 17690293

9

Microsecond molecular dynamics simulation shows effect of slow loop dynamics on backbone amide order parameters of proteins.

Maragakis P, Lindorff-Larsen K, Eastwood MP, Dror RO, Klepeis JL, Arkin IT, Jensen MØ, Xu H, Trbovic N, Friesner RA, Palmer AG III, Shaw DE. Maragakis P, et al. Among authors: dror ro. J Phys Chem B. 2008 May 15;112(19):6155-8. doi: 10.1021/jp077018h. Epub 2008 Mar 1. J Phys Chem B. 2008. PMID: 18311962 Free PMC article.

10

Dynamic control of slow water transport by aquaporin 0: implications for hydration and junction stability in the eye lens.

Jensen MØ, Dror RO, Xu H, Borhani DW, Arkin IT, Eastwood MP, Shaw DE. Jensen MØ, et al. Among authors: dror ro. Proc Natl Acad Sci U S A. 2008 Sep 23;105(38):14430-5. doi: 10.1073/pnas.0802401105. Epub 2008 Sep 11. Proc Natl Acad Sci U S A. 2008. PMID: 18787121 Free PMC article.

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