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Showing 1 to 12 of 196 entries
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[Use and abuse of drugs].

Tidsskrift for den Norske laegeforening : tidsskrift for praktisk medicin, ny raekke

Romcke O.
PMID: 5980400
Tidsskr Nor Laegeforen. 1966 Dec 01;86(23):1612-4.

No abstract available.

Using sildenafil (viagra) to treat congenital lymphatic malformations of the head and neck, our experience.

International journal of pediatric otorhinolaryngology

Rocke J, Quail G, Copley G.
PMID: 28390608
Int J Pediatr Otorhinolaryngol. 2017 May;96:25-27. doi: 10.1016/j.ijporl.2017.03.007. Epub 2017 Mar 06.

No abstract available.

Benthic protists and fungi of Mediterranean deep hypsersaline anoxic basin redoxcline sediments.

Frontiers in microbiology

Bernhard JM, Kormas K, Pachiadaki MG, Rocke E, Beaudoin DJ, Morrison C, Visscher PT, Cobban A, Starczak VR, Edgcomb VP.
PMID: 25452749
Front Microbiol. 2014 Nov 12;5:605. doi: 10.3389/fmicb.2014.00605. eCollection 2014.

Some of the most extreme marine habitats known are the Mediterranean deep hypersaline anoxic basins (DHABs; water depth ∼3500 m). Brines of DHABs are nearly saturated with salt, leading many to suspect they are uninhabitable for eukaryotes. While diverse...

Simulation of femtosecond "double-slit" experiments for a chromophore in a dissipative environment.

The Journal of chemical physics

Gelin MF, Tanimura Y, Domcke W.
PMID: 24320375
J Chem Phys. 2013 Dec 07;139(21):214302. doi: 10.1063/1.4832876.

We performed simulations of the prototypical femtosecond "double-slit" experiment with strong pulsed laser fields for a chromophore in solution. The chromophore is modeled as a system with two electronic levels and a single Franck-Condon active underdamped vibrational mode. All...

Photocatalytic Water Splitting with the Acridine Chromophore: A Computational Study.

The journal of physical chemistry. B

Liu X, Karsili TN, Sobolewski AL, Domcke W.
PMID: 26215204
J Phys Chem B. 2015 Aug 20;119(33):10664-72. doi: 10.1021/acs.jpcb.5b04833. Epub 2015 Aug 07.

The hydrogen-bonded acridine-water complex is considered as a model system for the exploration of photochemical reactions which can lead to the splitting of water into H(•) and OH(•) radicals. The vertical excitation energies of the lowest singlet and triplet...

Long term prognosis of myocardial infarction; analysis in relation to Russeks classification of good and poor risk cases.

Acta medica Scandinavica. Supplementum

KAHRS T, LINGJAERDE P, OLSEN OC, ROMCKE O.
PMID: 13394188
Acta Med Scand Suppl. 1956;319:17-26. doi: 10.1111/j.0954-6820.1956.tb06291.x.

No abstract available.

Photochemistry of water: the (H2O)5 cluster.

The Journal of chemical physics

Sobolewski AL, Domcke W.
PMID: 15918717
J Chem Phys. 2005 May 08;122(18):184320. doi: 10.1063/1.1896360.

The structures of the cyclic water pentamer, the H3O+(H2O)3OH- zwitterion, and the H3O(H2O)3OH biradical form of the (H2O)5 cluster have been determined with the second-order Møller-Plesset method and with density-functional theory (DFT). The vertical singlet excitation energies of these...

Time- and frequency-resolved fluorescence spectra of nonadiabatic dissipative systems: what photons can tell us.

The Journal of chemical physics

Egorova D, Gelin MF, Domcke W.
PMID: 15847478
J Chem Phys. 2005 Apr 01;122(13):134504. doi: 10.1063/1.1862618.

The monitoring of the excited-state dynamics by time- and frequency-resolved spontaneous emission spectroscopy has been studied in detail for a model exhibiting an excited-state curve crossing. The model represents characteristic aspects of the photoinduced ultrafast dynamics in large molecules...

Importance of spin-orbit coupling for the assignment of the photodetachment spectra of AuX2- (X=Cl, Br, and I).

Chemphyschem : a European journal of chemical physics and physical chemistry

Mishra S, Vallet V, Domcke W.
PMID: 16514700
Chemphyschem. 2006 Mar 13;7(3):723-7. doi: 10.1002/cphc.200500554.

Recently, photodetachment spectra of AuX2-, X=Cl, Br, and I, have been reported [D. Schröder et al., Angew. Chem. Int. Ed. 2003, 42, 311] followed by a scalar-relativistic theoretical study of the assignment of these spectra [B. Dai, J. Yang,...

Calculation of the vibronic structure of the photodetachment spectra of CCCl- and CCBr-.

The Journal of chemical physics

Mishra S, Vallet V, Poluyanov LV, Domcke W.
PMID: 17092093
J Chem Phys. 2006 Oct 28;125(16):164327. doi: 10.1063/1.2363193.

The vibronic structure of the closely spaced and strongly coupled X 2Sigma+ and A 2Pi states in the photodetachment spectra of CCCl- and CCBr- has been calculated by considering Sigma-Pi vibronic coupling together with spin-orbit coupling. The stretching modes...

Ensemble methods for classification in cheminformatics.

Journal of chemical information and computer sciences

Merkwirth C, Mauser H, Schulz-Gasch T, Roche O, Stahl M, Lengauer T.
PMID: 15554666
J Chem Inf Comput Sci. 2004 Nov-Dec;44(6):1971-8. doi: 10.1021/ci049850e.

We describe the application of ensemble methods to binary classification problems on two pharmaceutical compound data sets. Several variants of single and ensembles models of k-nearest neighbors classifiers, support vector machines (SVMs), and single ridge regression models are compared....

Photoinduced dynamics of ethene in the N, V, and Z valence states: a six-dimensional nonadiabatic quantum dynamics investigation.

The Journal of chemical physics

Viel A, Krawczyk RP, Manthe U, Domcke W.
PMID: 15268130
J Chem Phys. 2004 Jun 15;120(23):11000-10. doi: 10.1063/1.1740696.

The photoinduced dynamics of ethene following pi-->pi(*) excitation is investigated by quantum wave-packet dynamics on three coupled six-dimensional diabatic potential-energy surfaces representing the N, V, and Z valence states, which have been developed previously. The C-C stretching and torsion,...

Showing 1 to 12 of 196 entries