Wick CR - Search Results

1

A Fluorescent Benzo[g]isoquinoline-Based HIF Prolyl Hydroxylase Inhibitor for Cellular Imaging.

Mayer M, Fey K, Heinze E, Wick CR, Abboud MI, Yeh TL, Tumber A, Orth N, Schley G, Buchholz B, Clark T, Schofield CJ, Willam C, Burzlaff N. Mayer M, et al. Among authors: wick cr. ChemMedChem. 2019 Jan 8;14(1):94-99. doi: 10.1002/cmdc.201800483. Epub 2018 Dec 21. ChemMedChem. 2019. PMID: 30380199

2

Predicting the sites and energies of noncovalent intermolecular interactions using local properties.

El Kerdawy A, Wick CR, Hennemann M, Clark T. El Kerdawy A, et al. Among authors: wick cr. J Chem Inf Model. 2012 Apr 23;52(4):1061-71. doi: 10.1021/ci300095x. Epub 2012 Apr 13. J Chem Inf Model. 2012. PMID: 22458324

3

Self-consistent field convergence for proteins: a comparison of full and localized-molecular-orbital schemes.

Wick CR, Hennemann M, Stewart JJ, Clark T. Wick CR, et al. J Mol Model. 2014 Mar;20(3):2159. doi: 10.1007/s00894-014-2159-y. Epub 2014 Feb 28. J Mol Model. 2014. PMID: 24573500 Free article.

4

Multiply bonded metal(II) acetate (rhodium, ruthenium, and molybdenum) complexes with the trans-1,2-bis(N-methylimidazol-2-yl)ethylene ligand.

Fritsch N, Wick CR, Waidmann T, Dral PO, Tucher J, Heinemann FW, Shubina TE, Clark T, Burzlaff N. Fritsch N, et al. Among authors: wick cr. Inorg Chem. 2014 Dec 1;53(23):12305-14. doi: 10.1021/ic501435a. Epub 2014 Nov 13. Inorg Chem. 2014. PMID: 25393757

5

On bond-critical points in QTAIM and weak interactions.

Wick CR, Clark T. Wick CR, et al. J Mol Model. 2018 May 31;24(6):142. doi: 10.1007/s00894-018-3684-x. J Mol Model. 2018. PMID: 29855704

6

Improving the Performance of Supported Ionic Liquid Phase Catalysts for the Ultra-Low-Temperature Water Gas Shift Reaction Using Organic Salt Additives.

Wolf P, Wick CR, Mehler J, Blaumeiser D, Schötz S, Bauer T, Libuda J, Smith D, Smith AS, Haumann M. Wolf P, et al. Among authors: wick cr. ACS Catal. 2022 May 6;12(9):5661-5672. doi: 10.1021/acscatal.1c05979. Epub 2022 Apr 27. ACS Catal. 2022. PMID: 35572184 Free PMC article.

7

Modeling the Reactions Catalyzed by Coenzyme B₁₂ Dependent Enzymes: Accuracy and Cost-Quality Balance.

Wick CR, Smith DM. Wick CR, et al. J Phys Chem A. 2018 Feb 15;122(6):1747-1755. doi: 10.1021/acs.jpca.7b11798. Epub 2018 Feb 7. J Phys Chem A. 2018. PMID: 29389127

8

Mechanism of the Water-Gas Shift Reaction Catalyzed by Efficient Ruthenium-Based Catalysts: A Computational and Experimental Study.

Stepić R, Wick CR, Strobel V, Berger D, Vučemilović-Alagić N, Haumann M, Wasserscheid P, Smith AS, Smith DM. Stepić R, et al. Among authors: wick cr. Angew Chem Int Ed Engl. 2019 Jan 14;58(3):741-745. doi: 10.1002/anie.201811627. Epub 2018 Dec 12. Angew Chem Int Ed Engl. 2019. PMID: 30467935

9

Insights from molecular dynamics simulations on structural organization and diffusive dynamics of an ionic liquid at solid and vacuum interfaces.

Vučemilović-Alagić N, Banhatti RD, Stepić R, Wick CR, Berger D, Gaimann MU, Baer A, Harting J, Smith DM, Smith AS. Vučemilović-Alagić N, et al. Among authors: wick cr. J Colloid Interface Sci. 2019 Oct 1;553:350-363. doi: 10.1016/j.jcis.2019.06.017. Epub 2019 Jun 6. J Colloid Interface Sci. 2019. PMID: 31220709

10

Structural characterization of an ionic liquid in bulk and in nano-confined environment using data from MD simulations.

Vučemilović-Alagić N, Banhatti RD, Stepić R, Wick CR, Berger D, Gaimann MU, Baer A, Harting J, Smith DM, Smith AS. Vučemilović-Alagić N, et al. Among authors: wick cr. Data Brief. 2019 Nov 23;28:104794. doi: 10.1016/j.dib.2019.104794. eCollection 2020 Feb. Data Brief. 2019. PMID: 31871969 Free PMC article.

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