Seeliger D - Search Results

1

Second M₃ muscarinic receptor binding site contributes to bronchoprotection by tiotropium.

Kistemaker LEM, Elzinga CRS, Tautermann CS, Pieper MP, Seeliger D, Alikhil S, Schmidt M, Meurs H, Gosens R. Kistemaker LEM, et al. Among authors: seeliger d. Br J Pharmacol. 2019 Aug;176(16):2864-2876. doi: 10.1111/bph.14707. Epub 2019 Jul 2. Br J Pharmacol. 2019. PMID: 31077341 Free PMC article.

2

Molecular basis for the long duration of action and kinetic selectivity of tiotropium for the muscarinic M3 receptor.

Tautermann CS, Kiechle T, Seeliger D, Diehl S, Wex E, Banholzer R, Gantner F, Pieper MP, Casarosa P. Tautermann CS, et al. Among authors: seeliger d. J Med Chem. 2013 Nov 14;56(21):8746-56. doi: 10.1021/jm401219y. Epub 2013 Oct 25. J Med Chem. 2013. PMID: 24088171

3

What can we learn from molecular dynamics simulations for GPCR drug design?

Tautermann CS, Seeliger D, Kriegl JM. Tautermann CS, et al. Among authors: seeliger d. Comput Struct Biotechnol J. 2014 Dec 10;13:111-21. doi: 10.1016/j.csbj.2014.12.002. eCollection 2015. Comput Struct Biotechnol J. 2014. PMID: 25709761 Free PMC article.

4

Enhancing Drug Residence Time by Shielding of Intra-Protein Hydrogen Bonds: A Case Study on CCR2 Antagonists.

Magarkar A, Schnapp G, Apel AK, Seeliger D, Tautermann CS. Magarkar A, et al. Among authors: seeliger d. ACS Med Chem Lett. 2019 Feb 7;10(3):324-328. doi: 10.1021/acsmedchemlett.8b00590. eCollection 2019 Mar 14. ACS Med Chem Lett. 2019. PMID: 30891134 Free PMC article.

5

BIreactive: A Machine-Learning Model to Estimate Covalent Warhead Reactivity.

Palazzesi F, Hermann MR, Grundl MA, Pautsch A, Seeliger D, Tautermann CS, Weber A. Palazzesi F, et al. Among authors: seeliger d. J Chem Inf Model. 2020 Jun 22;60(6):2915-2923. doi: 10.1021/acs.jcim.9b01058. Epub 2020 May 6. J Chem Inf Model. 2020. PMID: 32250627

6

Computational method to identify druggable binding sites that target protein-protein interactions.

Li H, Kasam V, Tautermann CS, Seeliger D, Vaidehi N. Li H, et al. Among authors: seeliger d. J Chem Inf Model. 2014 May 27;54(5):1391-400. doi: 10.1021/ci400750x. Epub 2014 May 7. J Chem Inf Model. 2014. PMID: 24762202

7

Fragment Binding Pose Predictions Using Unbiased Simulations and Markov-State Models.

Linker SM, Magarkar A, Köfinger J, Hummer G, Seeliger D. Linker SM, et al. Among authors: seeliger d. J Chem Theory Comput. 2019 Sep 10;15(9):4974-4981. doi: 10.1021/acs.jctc.9b00069. Epub 2019 Aug 22. J Chem Theory Comput. 2019. PMID: 31402652

8

Structural Mechanisms of Voltage Sensing in G Protein-Coupled Receptors.

Vickery ON, Machtens JP, Tamburrino G, Seeliger D, Zachariae U. Vickery ON, et al. Among authors: seeliger d. Structure. 2016 Jun 7;24(6):997-1007. doi: 10.1016/j.str.2016.04.007. Epub 2016 May 19. Structure. 2016. PMID: 27210286 Free PMC article.

9

Hybrid Screening Approach for Very Small Fragments: X-ray and Computational Screening on FKBP51.

Draxler SW, Bauer M, Eickmeier C, Nadal S, Nar H, Rangel Rojas D, Seeliger D, Zeeb M, Fiegen D. Draxler SW, et al. Among authors: seeliger d. J Med Chem. 2020 Jun 11;63(11):5856-5864. doi: 10.1021/acs.jmedchem.0c00120. Epub 2020 Jun 3. J Med Chem. 2020. PMID: 32420743

10

Molecular structure of human GM-CSF in complex with a disease-associated anti-human GM-CSF autoantibody and its potential biological implications.

Blech M, Seeliger D, Kistler B, Bauer MM, Hafner M, Hörer S, Zeeb M, Nar H, Park JE. Blech M, et al. Among authors: seeliger d. Biochem J. 2012 Oct 15;447(2):205-15. doi: 10.1042/BJ20120884. Biochem J. 2012. PMID: 22839360

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