Overgaard J - Search Results

1

X-N charge density analysis of the hydrogen bonding motif in 1-(2-hydroxy-5-nitrophenyl)ethanone.

Hibbs DE, Overgaard J, Piltz RO. Hibbs DE, et al. Among authors: overgaard j. Org Biomol Chem. 2003 Apr 7;1(7):1191-8. doi: 10.1039/b211683a. Org Biomol Chem. 2003. PMID: 12926394

2

Experimental and theoretical charge density study of the neurotransmitter taurine.

Hibbs DE, Austin-Woods CJ, Platts JA, Overgaard J, Turner P. Hibbs DE, et al. Among authors: overgaard j. Chemistry. 2003 Mar 3;9(5):1075-84. doi: 10.1002/chem.200390100. Chemistry. 2003. PMID: 12596143

3

Experimental and theoretical charge distribution in (Z)-N-methyl-C-phenylnitrone.

Hibbs DE, Hanrahan JR, Hursthouse MB, Knight DW, Overgaard J, Turner P, Piltz RO, Waller MP. Hibbs DE, et al. Among authors: overgaard j. Org Biomol Chem. 2003 Mar 21;1(6):1034-40. doi: 10.1039/b210698a. Org Biomol Chem. 2003. PMID: 12929644

4

Experimental and theoretical electron density distribution and magnetic properties of the butterfly-like complex [Fe(4)O(2)(O(2)CCMe(3))(8)(NC(5)H(4)Me)(2)].2CH(3)CN.

Overgaard J, Hibbs DE, Rentschler E, Timco GA, Larsen FK. Overgaard J, et al. Inorg Chem. 2003 Nov 17;42(23):7593-601. doi: 10.1021/ic034062c. Inorg Chem. 2003. PMID: 14606856

5

The experimental electron density in polymorphs A and B of the anti-ulcer drug famotidine.

Overgaard J, Hibbs DE. Overgaard J, et al. Acta Crystallogr A. 2004 Sep;60(Pt 5):480-7. doi: 10.1107/S0108767304017891. Epub 2004 Aug 26. Acta Crystallogr A. 2004. PMID: 15477688

6

Experimental charge density of a potential DHO synthetase inhibitor: dimethyl-trans-2-oxohexahydro-pyrimidine-4,6-dicarboxylate.

Hibbs DE, Overgaard J, Howard ST, Nguyen TH. Hibbs DE, et al. Among authors: overgaard j. Org Biomol Chem. 2005 Feb 7;3(3):441-7. doi: 10.1039/b416118a. Epub 2005 Jan 5. Org Biomol Chem. 2005. PMID: 15678181

7

Experimental electron density study of a complex between copper(II) and the antibacterial quinolone family member ciprofloxacin.

Overgaard J, Turel I, Hibbs DE. Overgaard J, et al. Dalton Trans. 2007 Jun 7;(21):2171-8. doi: 10.1039/b700248c. Epub 2007 Mar 29. Dalton Trans. 2007. PMID: 17514338

8

Experimental and theoretical charge density distribution in two ternary cobalt(III) complexes of aromatic amino acids.

Overgaard J, Waller MP, Piltz R, Platts JA, Emseis P, Leverett P, Williams PA, Hibbs DE. Overgaard J, et al. J Phys Chem A. 2007 Oct 11;111(40):10123-33. doi: 10.1021/jp068621n. Epub 2007 Sep 18. J Phys Chem A. 2007. PMID: 17877334

9

Relationships between electron density and magnetic properties in water-bridged dimetal complexes.

Overgaard J, Walsh JP, Hathwar VR, Jørgensen MR, Hoffman C, Platts JA, Piltz R, Winpenny RE. Overgaard J, et al. Inorg Chem. 2014 Nov 3;53(21):11531-9. doi: 10.1021/ic501411w. Epub 2014 Oct 20. Inorg Chem. 2014. PMID: 25330274

10

A comparison of the experimental and theoretical charge density distributions in two polymorphic modifications of piroxicam.

Lai F, Du JJ, Williams PA, Váradi L, Baker D, Groundwater PW, Overgaard J, Platts JA, Hibbs DE. Lai F, et al. Among authors: overgaard j. Phys Chem Chem Phys. 2016 Oct 19;18(41):28802-28818. doi: 10.1039/c6cp02690g. Phys Chem Chem Phys. 2016. PMID: 27722530

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