van der Spoel D - Search Results

1

Transient isomers in the photodissociation of bromoiodomethane.

Marcellini M, Nasedkin A, Zietz B, Petersson J, Vincent J, Palazzetti F, Malmerberg E, Kong Q, Wulff M, van der Spoel D, Neutze R, Davidsson J. Marcellini M, et al. Among authors: van der spoel d. J Chem Phys. 2018 Apr 7;148(13):134307. doi: 10.1063/1.5005595. J Chem Phys. 2018. PMID: 29626862 Free article.

2

Accurate absolute free energies for ligand-protein binding based on non-equilibrium approaches.

Gapsys V, Yildirim A, Aldeghi M, Khalak Y, van der Spoel D, de Groot BL. Gapsys V, et al. Among authors: van der spoel d. Commun Chem. 2021 May 11;4(1):61. doi: 10.1038/s42004-021-00498-y. Commun Chem. 2021. PMID: 36697634 Free PMC article.

3

Potential for biomolecular imaging with femtosecond X-ray pulses.

Neutze R, Wouts R, van der Spoel D, Weckert E, Hajdu J. Neutze R, et al. Among authors: van der spoel d. Nature. 2000 Aug 17;406(6797):752-7. doi: 10.1038/35021099. Nature. 2000. PMID: 10963603

4

Deformation of helix C in the low temperature L-intermediate of bacteriorhodopsin.

Edman K, Royant A, Larsson G, Jacobson F, Taylor T, van der Spoel D, Landau EM, Pebay-Peyroula E, Neutze R. Edman K, et al. Among authors: van der spoel d. J Biol Chem. 2004 Jan 16;279(3):2147-58. doi: 10.1074/jbc.M300709200. Epub 2003 Oct 7. J Biol Chem. 2004. PMID: 14532280 Free article.

5

Temperature and structural changes of water clusters in vacuum due to evaporation.

Caleman C, van der Spoel D. Caleman C, et al. Among authors: van der spoel d. J Chem Phys. 2006 Oct 21;125(15):154508. doi: 10.1063/1.2357591. J Chem Phys. 2006. PMID: 17059273

6

A proposed time-resolved X-ray scattering approach to track local and global conformational changes in membrane transport proteins.

Andersson M, Vincent J, van der Spoel D, Davidsson J, Neutze R. Andersson M, et al. Among authors: van der spoel d. Structure. 2008 Jan;16(1):21-8. doi: 10.1016/j.str.2007.10.016. Structure. 2008. PMID: 18184580 Free article.

7

Time-resolved WAXS reveals accelerated conformational changes in iodoretinal-substituted proteorhodopsin.

Malmerberg E, Omran Z, Hub JS, Li X, Katona G, Westenhoff S, Johansson LC, Andersson M, Cammarata M, Wulff M, van der Spoel D, Davidsson J, Specht A, Neutze R. Malmerberg E, et al. Among authors: van der spoel d. Biophys J. 2011 Sep 21;101(6):1345-53. doi: 10.1016/j.bpj.2011.07.050. Epub 2011 Sep 20. Biophys J. 2011. PMID: 21943415 Free PMC article.

8

Deciphering solution scattering data with experimentally guided molecular dynamics simulations.

Björling A, Niebling S, Marcellini M, van der Spoel D, Westenhoff S. Björling A, et al. Among authors: van der spoel d. J Chem Theory Comput. 2015 Feb 10;11(2):780-7. doi: 10.1021/ct5009735. J Chem Theory Comput. 2015. PMID: 25688181 Free PMC article.

9

Deconvoluting Protein (Un)folding Structural Ensembles Using X-Ray Scattering, Nuclear Magnetic Resonance Spectroscopy and Molecular Dynamics Simulation.

Nasedkin A, Marcellini M, Religa TL, Freund SM, Menzel A, Fersht AR, Jemth P, van der Spoel D, Davidsson J. Nasedkin A, et al. Among authors: van der spoel d. PLoS One. 2015 May 6;10(5):e0125662. doi: 10.1371/journal.pone.0125662. eCollection 2015. PLoS One. 2015. PMID: 25946337 Free PMC article.

10

Evaporation from water clusters containing singly charged ions.

Caleman C, van der Spoel D. Caleman C, et al. Among authors: van der spoel d. Phys Chem Chem Phys. 2007 Oct 7;9(37):5105-11. doi: 10.1039/b706243e. Epub 2007 Jul 31. Phys Chem Chem Phys. 2007. PMID: 17878986

Save citations to file

Email citations

Send citations to clipboard

Add to Collections

Add to My Bibliography

Create a file for external citation management software

Your saved search

Your RSS Feed

My Custom Filters

Publication date

Text availability

Article attribute

Article type

Article Language

Species

Sex

Age

Other

126 results

Search Page

Filters