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Showing 1 to 12 of 245 entries
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APhA: on the move.

American pharmacy

Schlegel JF.
PMID: 3728300
Am Pharm. 1986 Jun;(6):37-9.

No abstract available.

Training future communicators.

American pharmacy

Pillow WF, Schlegel JF.
PMID: 7270410
Am Pharm. 1981 Jul;(7):43-5.

No abstract available.

Angle-Dependent Ionization of Small Molecules by Time-Dependent Configuration Interaction and an Absorbing Potential.

The journal of physical chemistry letters

Krause P, Schlegel HB.
PMID: 26266516
J Phys Chem Lett. 2015 Jun 04;6(11):2140-6. doi: 10.1021/acs.jpclett.5b00929. Epub 2015 May 27.

The angle-dependence of strong field ionization of O2, N2, CO2, and CH2O has been studied theoretically using a time-dependent configuration interaction approach with a complex absorbing potential (TDCIS-CAP). Calculation of the ionization yields as a function of the direction...

HNSCC cells resistant to EGFR pathway inhibitors are hypermutated and sensitive to DNA damaging substances.

American journal of cancer research

Schulz D, Wirth M, Piontek G, Buchberger AM, Schlegel J, Reiter R, Multhoff G, Pickhard A.
PMID: 27725902
Am J Cancer Res. 2016 Sep 01;6(9):1963-1975. eCollection 2016.

Despite remarkable successes with targeted therapies in the treatment of cancer, resistance can occur which limits the clinical outcome. In this study, we generated and characterized resistant cell clones derived from two different head and neck squamous cell carcinoma...

Theoretical Determination of One-Electron Oxidation Potentials for Nucleic Acid Bases.

Journal of chemical theory and computation

Psciuk BT, Lord RL, Munk BH, Schlegel HB.
PMID: 26593200
J Chem Theory Comput. 2012 Dec 11;8(12):5107-23. doi: 10.1021/ct300550x. Epub 2012 Sep 13.

The oxidation potentials for N-methyl substituted nucleic acid bases guanine, adenine, cytosine, thymine, uracil, xanthine, and 8-oxoguanine were computed using B3LYP and CBS-QB3 with the SMD solvation model. Acid-base and tautomeric equilibria present in aqueous solution were accounted for...

Strong field ionization rates simulated with time-dependent configuration interaction and an absorbing potential.

The Journal of chemical physics

Krause P, Sonk JA, Schlegel HB.
PMID: 24811631
J Chem Phys. 2014 May 07;140(17):174113. doi: 10.1063/1.4874156.

Ionization rates of molecules have been modeled with time-dependent configuration interaction simulations using atom centered basis sets and a complex absorbing potential. The simulations agree with accurate grid-based calculations for the ionization of hydrogen atom as a function of...

Using Hessian Updating To Increase the Efficiency of a Hessian Based Predictor-Corrector Reaction Path Following Method.

Journal of chemical theory and computation

Hratchian HP, Schlegel HB.
PMID: 26641116
J Chem Theory Comput. 2005 Jan;1(1):61-9. doi: 10.1021/ct0499783.

The reaction path is a key concept in the theoretical description of a chemical reaction. The intrinsic reaction coordinate is defined as the steepest descent path in mass-weighted Cartesian coordinates that connects the transition state to reactants and products...

Bimetallic Cooperativity in Proton Reduction with an Amido-Bridged Cobalt Catalyst.

Chemistry (Weinheim an der Bergstrasse, Germany)

Kpogo KK, Mazumder S, Wang D, Schlegel HB, Fiedler AT, Verani CN.
PMID: 28488285
Chemistry. 2017 Jul 12;23(39):9272-9279. doi: 10.1002/chem.201701982. Epub 2017 Jun 23.

The bimetallic catalyst [Co

The Reading Free Dental Dispensary.

The Psychological clinic

Schlegel GS.
PMID: 28909416
Psychol Clin. 1910 Feb 15;3(9):249-254.

No abstract available.

Quantification and regulation of adipsin in human cerebrospinal fluid (CSF).

Clinical endocrinology

Schmid A, Hochberg A, Berghoff M, Schlegel J, Karrasch T, Kaps M, Schäffler A.
PMID: 26186410
Clin Endocrinol (Oxf). 2016 Feb;84(2):194-202. doi: 10.1111/cen.12856. Epub 2015 Aug 26.

CONTEXT: Data on quantification and regulation of adipsin in human cerebrospinal fluid (CSF) are sparse, and the physiological role of adipsin as an adipokine crossing the blood-brain barrier (BBB) is uncertain.OBJECTIVES: This study quantified adipsin concentrations in paired serum...

Two distinct superconducting phases in LiFeAs.

Scientific reports

Nag PK, Schlegel R, Baumann D, Grafe HJ, Beck R, Wurmehl S, Büchner B, Hess C.
PMID: 27297474
Sci Rep. 2016 Jun 14;6:27926. doi: 10.1038/srep27926.

A non-trivial temperature evolution of superconductivity including a temperature-induced phase transition between two superconducting phases or even a time-reversal symmetry breaking order parameter is in principle expected in multiband superconductors such as iron-pnictides. Here we present scanning tunnelling spectroscopy...

Electronic Modulation of the SOMO-HOMO Energy Gap in Iron(III) Complexes towards Unimolecular Current Rectification.

Chemistry (Weinheim an der Bergstrasse, Germany)

Wickramasinghe LD, Mazumder S, Kpogo KK, Staples RJ, Schlegel HB, Verani CN.
PMID: 27247249
Chemistry. 2016 Jul 25;22(31):10786-90. doi: 10.1002/chem.201602444. Epub 2016 Jun 27.

Amphiphilic five-coordinate iron(III) complexes with {N2 O2 Cl} and {N2 O3 } coordination spheres are studied to elucidate the roles of electronic structure on the mechanisms for current rectification. The presence of an apical chlorido or phenolato ligand plays...

Showing 1 to 12 of 245 entries