Research Output

Filter
Article
2015

Views from academia and industry on skills needed for the modern research environment

Talgar, C. P. & Goodey, N. M., 1 Sep 2015, In : Biochemistry and Molecular Biology Education. 43, 5, p. 324-332 9 p.

Research output: Contribution to journalArticle

4 Scopus citations
2014

207Pb and 119Sn solid-State NMR and relativistic density functional theory studies of the historic pigment lead-tin yellow type I and its reactivity in oil paintings

Catalano, J., Murphy, A., Yao, Y., Alkan, F., Zumbulyadis, N., Centeno, S. A. & Dybowski, C., 12 Aug 2014, In : Journal of Physical Chemistry A. 118, 36, p. 7952-7958 7 p.

Research output: Contribution to journalArticle

18 Scopus citations

Analytical first-order molecular properties and forces within the adiabatic connection random phase approximation

Burow, A. M., Bates, J. E., Furche, F. & Eshuis, H., 14 Jan 2014, In : Journal of Chemical Theory and Computation. 10, 1, p. 180-194 15 p.

Research output: Contribution to journalArticle

42 Scopus citations

Electrochemical X-ray fluorescence spectroscopy for trace heavy metal analysis: Enhancing X-ray fluorescence detection capabilities by four orders of magnitude

Hutton, L. A., O'Neil, G. D., Read, T. L., Ayres, Z. J., Newton, M. E. & MacPherson, J. V., 6 May 2014, In : Analytical Chemistry. 86, 9, p. 4566-4572 7 p.

Research output: Contribution to journalArticle

38 Scopus citations

Electrochemistry of aqueous colloidal graphene oxide on Pt electrodes

O'Neil, G. D., Weber, A. W., Buiculescu, R., Chaniotakis, N. A. & Kounaves, S. P., 12 Aug 2014, In : Langmuir. 30, 31, p. 9599-9606 8 p.

Research output: Contribution to journalArticle

6 Scopus citations

Evidence of martian perchlorate, chlorate, and nitrate in Mars meteorite EETA79001: Implications for oxidants and organics

Kounaves, S. P., Carrier, B. L., O'Neil, G. D., Stroble, S. T. & Claire, M. W., 1 Feb 2014, In : Icarus. 229, p. 206-213 8 p.

Research output: Contribution to journalArticle

81 Scopus citations

FDE-vdW: A van der Waals inclusive subsystem density-functional theory

Kevorkyants, R., Eshuis, H. & Pavanello, M., 28 Jul 2014, In : Journal of Chemical Physics. 141, 4, 044127.

Research output: Contribution to journalArticle

17 Scopus citations

Hydrogen bonding constrains free radical reaction dynamics at serine and threonine residues in peptides

Thomas, D. A., Sohn, C. H., Gao, J. & Beauchamp, J. L., 18 Sep 2014, In : Journal of Physical Chemistry A. 118, 37, p. 8380-8392 13 p.

Research output: Contribution to journalArticle

21 Scopus citations

Identification of the perchlorate parent salts at the Phoenix Mars landing site and possible implications

Kounaves, S. P., Chaniotakis, N. A., Chevrier, V. F., Carrier, B. L., Folds, K. E., Hansen, V. M., McElhoney, K. M., O'Neil, G. D. & Weber, A. W., 1 Apr 2014, In : Icarus. 232, p. 226-231 6 p.

Research output: Contribution to journalArticle

69 Scopus citations

Nuclear magnetic resonance spectra and 207pb chemical-shift tensors of lead carboxylates relevant to soap formation in oil paintings

Catalano, J., Yao, Y., Murphy, A., Zumbulyadis, N., Centeno, S. A. & Dybowski, C., 1 Mar 2014, In : Applied Spectroscopy. 68, 3, p. 280-286 7 p.

Research output: Contribution to journalArticle

20 Scopus citations

On the factors that control the reactivity of meta-benzynes

Gao, J., Jankiewicz, B. J., Reece, J., Sheng, H., Cramer, C. J., Nash, J. J. & Kenttämaa, H. I., Jun 2014, In : Chemical Science. 5, 6, p. 2205-2215 11 p.

Research output: Contribution to journalArticle

17 Scopus citations

Structure-activity studies of (-)-epigallocatechin gallate derivatives as HCV entry inhibitors

Bhat, R., Adam, A. T., Lee, J. J., Deloison, G., Rouillé, Y., Séron, K. & Rotella, D. P., 1 Sep 2014, In : Bioorganic and Medicinal Chemistry Letters. 24, 17, p. 4162-4165 4 p.

Research output: Contribution to journalArticle

10 Scopus citations

Towards the discovery of drug-like epigallocatechin gallate analogs as Hsp90 inhibitors

Bhat, R., Adam, A. T., Lee, J. J., Gasiewicz, T. A., Henry, E. C. & Rotella, D. P., 15 May 2014, In : Bioorganic and Medicinal Chemistry Letters. 24, 10, p. 2263-2266 4 p.

Research output: Contribution to journalArticle

10 Scopus citations

Unusual structure-energy correlations in intramolecular Diels-Alder reaction transition states

Żurek, J. M., Rae, R. L., Paterson, M. J. & Bebbington, M. W. P., 1 Oct 2014, In : Molecules. 19, 10, p. 15535-15545 11 p.

Research output: Contribution to journalArticle

Open Access
3 Scopus citations
2013

Biomimetic reagents for the selective free radical and acid-base chemistry of glycans: Application to glycan structure determination by mass spectrometry

Gao, J., Thomas, D. A., Sohn, C. H. & Beauchamp, J. L., 24 Jul 2013, In : Journal of the American Chemical Society. 135, 29, p. 10684-10692 9 p.

Research output: Contribution to journalArticle

35 Scopus citations

Halogenation effects in intramolecular furan Diels-Alder reactions: Broad scope synthetic and computational studies

Rae, R. L., Zurek, J. M., Paterson, M. J. & Bebbington, M. W. P., 7 Dec 2013, In : Organic and Biomolecular Chemistry. 11, 45, p. 7946-7952 7 p.

Research output: Contribution to journalArticle

Open Access
9 Scopus citations

Kinetic mechanism of indole-3-glycerol phosphate synthase

Schlee, S., Dietrich, S., Kurćon, T., Delaney, P., Goodey, N. M. & Sterner, R., 8 Jan 2013, In : Biochemistry. 52, 1, p. 132-142 11 p.

Research output: Contribution to journalArticle

8 Scopus citations

Structural evidence: A single charged residue affects substrate binding in cytochrome P450 BM-3

Catalano, J., Sadre-Bazzaz, K., Amodeo, G. A., Tong, L. & McDermott, A., 1 Oct 2013, In : Biochemistry. 52, 39, p. 6807-6815 9 p.

Research output: Contribution to journalArticle

9 Scopus citations

Temporally overlapped but uncoupled motions in dihydrofolate reductase catalysis

Liu, C. T., Wang, L., Goodey, N. M., Hanoian, P. & Benkovic, S. J., 13 Aug 2013, In : Biochemistry. 52, 32, p. 5332-5334 3 p.

Research output: Contribution to journalArticle

9 Scopus citations

Theoretical models for electrochemical impedance spectroscopy and local ζ-potential of unfolded proteins in nanopores

Vitarelli, M. J. & Talaga, D. S., 14 Sep 2013, In : Journal of Chemical Physics. 139, 10, 105101.

Research output: Contribution to journalArticle

1 Scopus citations

The spectral properties of (-)-epigallocatechin 3-O-gallate (EGCG) fluorescence in different solvents: Dependence on solvent polarity

Snitsarev, V., Young, M. N., Miller, R. M. S. & Rotella, D. P., 22 Nov 2013, In : PLoS ONE. 8, 11, e79834.

Research output: Contribution to journalArticle

15 Scopus citations
2012

Adsorption behavior of EDTA-graphene oxide for Pb (II) removal

Madadrang, C. J., Kim, H. Y., Gao, G., Wang, N., Zhu, J., Feng, H., Gorring, M., Kasner, M. & Hou, S., 28 Mar 2012, In : ACS Applied Materials and Interfaces. 4, 3, p. 1186-1193 8 p.

Research output: Contribution to journalArticle

500 Scopus citations

Basis set convergence of molecular correlation energy differences within the random phase approximation

Eshuis, H. & Furche, F., 28 Feb 2012, In : Journal of Chemical Physics. 136, 8, 084105.

Research output: Contribution to journalArticle

69 Scopus citations

DPD simulation of protein conformations: From α-helices to β-structures

Vishnyakov, A., Talaga, D. S. & Neimark, A. V., 1 Nov 2012, In : Journal of Physical Chemistry Letters. 3, 21, p. 3081-3087 7 p.

Research output: Contribution to journalArticle

46 Scopus citations

Electron correlation methods based on the random phase approximation

Eshuis, H., Bates, J. E. & Furche, F., 1 Jan 2012, In : Theoretical Chemistry Accounts. 131, 1, 1084.

Research output: Contribution to journalArticle

256 Scopus citations

Gold(i)-catalysed synthesis of cyclic sulfamidates by intramolecular allene hydroamination

Higginbotham, M. C. M. & Bebbington, M. W. P., 7 Aug 2012, In : Chemical Communications. 48, 61, p. 7565-7567 3 p.

Research output: Contribution to journalArticle

22 Scopus citations

HPLC/APCI mass spectrometry of saturated and unsaturated hydrocarbons by using hydrocarbon solvents as the APCI reagent and HPLC mobile phase

Gao, J., Owen, B. C., Borton, D. J., Jin, Z. & Kenttämaa, H. I., 1 May 2012, In : Journal of the American Society for Mass Spectrometry. 23, 5, p. 816-822 7 p.

Research output: Contribution to journalArticle

23 Scopus citations

Ion-molecule reactions for the differentiation of primary, secondary and tertiary hydroxyl functionalities in protonated analytes in a tandem mass spectrometer

Fu, M., Duan, P., Gao, J. & Kenttämaa, H. I., 21 Dec 2012, In : Analyst. 137, 24, p. 5720-5722 3 p.

Research output: Contribution to journalArticle

10 Scopus citations

Platinum nanoparticles anchored on chelating group-modified graphene for methanol oxidation

Wietecha, M. S., Zhu, J., Gao, G., Wang, N., Feng, H., Gorring, M. L., Kasner, M. & Hou, S., 15 Jan 2012, In : Journal of Power Sources. 198, p. 30-35 6 p.

Research output: Contribution to journalArticle

52 Scopus citations

Stability and lifetime of potassium solid-contact ion selective electrodes for continuous and autonomous measurements

McElhoney, K., O'Neil, G. D., Chaniotakis, N. A. & Kounaves, S. P., 1 Nov 2012, In : Electroanalysis. 24, 11, p. 2071-2078 8 p.

Research output: Contribution to journalArticle

6 Scopus citations

Substituent effects on the nonradical reactivity of 4-dehydropyridinium cation

Jankiewicz, B. J., Gao, J., Reece, J. N., Vinueza, N. R., Narra, P., Nash, J. J. & Kenttämaa, H. I., 29 Mar 2012, In : Journal of Physical Chemistry A. 116, 12, p. 3089-3093 5 p.

Research output: Contribution to journalArticle

4 Scopus citations

Synthesis of (L)-4-fluorotryptophan

Konas, D. W., Seci, D. & Tamimi, S., 1 Jan 2012, In : Synthetic Communications. 42, 1, p. 144-152 9 p.

Research output: Contribution to journalArticle

6 Scopus citations
2011

An exploratory investigation of the risk of pathogenic contamination at selected New Jersey skilled nursing and assisted living residences

Feldman, C., Nothstein, G., Somaiya, C. K., Obeidallah, H., Silverthorne, E., Wunderlich, S. & Goodey, N. M., 1 Mar 2011, In : Perspectives in Public Health. 131, 2, p. 85-88 4 p.

Research output: Contribution to journalArticle

3 Scopus citations

A parameter-free density functional that works for noncovalent interactions

Eshuis, H. & Furche, F., 5 May 2011, In : Journal of Physical Chemistry Letters. 2, 9, p. 983-989 7 p.

Research output: Contribution to journalArticle

109 Scopus citations

Carbon disulfide reagent allows the characterization of nonpolar analytes by atmospheric pressure chemical ionization mass spectrometry

Owen, B. C., Gao, J., Borton, D. J., Amundson, L. M., Archibold, E. F., Tan, X., Azyat, K., Tykwinski, R., Gray, M. & Kenttämaa, H. I., 30 Jul 2011, In : Rapid Communications in Mass Spectrometry. 25, 14, p. 1924-1928 5 p.

Research output: Contribution to journalArticle

22 Scopus citations

Carbon-nanofiber-based nanocomposite membrane as a highly stable solid-state junction for reference electrodes

O'Neil, G. D., Buiculescu, R., Kounaves, S. P. & Chaniotakis, N. A., 15 Jul 2011, In : Analytical Chemistry. 83, 14, p. 5749-5753 5 p.

Research output: Contribution to journalArticle

10 Scopus citations

Determining nanocapillary geometry from electrochemical impedance spectroscopy using a variable topology network circuit model

Vitarelli, M. J., Prakash, S. & Talaga, D. S., 15 Jan 2011, In : Analytical Chemistry. 83, 2, p. 533-541 9 p.

Research output: Contribution to journalArticle

18 Scopus citations

Development of a fluorescently labeled thermostable DHFR for studying conformational changes associated with inhibitor binding

Goodey, N. M., Alapa, M. T., Hagmann, D. F., Korunow, S. G., Mauro, A. K., Kwon, K. S. & Hall, S. M., 30 Sep 2011, In : Biochemical and Biophysical Research Communications. 413, 3, p. 442-447 6 p.

Research output: Contribution to journalArticle

5 Scopus citations

Evidence for concerted electron proton transfer in charge recombination between FADH- and 306Trp in Escherichia coli photolyase

Zieba, A. A., Richardson, C., Lucero, C., Dieng, S. D., Gindt, Y. M. & Schelvis, J. P. M., 25 May 2011, In : Journal of the American Chemical Society. 133, 20, p. 7824-7836 13 p.

Research output: Contribution to journalArticle

15 Scopus citations

Evidence from thermodynamics that DNA photolyase recognizes a solvent-exposed CPD lesion

Wilson, T. J., Crystal, M. A., Rohrbaugh, M. C., Sokolowsky, K. P. & Gindt, Y. M., 24 Nov 2011, In : Journal of Physical Chemistry B. 115, 46, p. 13746-13754 9 p.

Research output: Contribution to journalArticle

8 Scopus citations

Human p38 mitogen-activated protein kinase inhibitor drugs inhibit Plasmodium falciparum replication

Brumlik, M. J., Nkhoma, S., Kious, M. J., Thompson, G. R., Patterson, T. F., Siekierka, J. J., Anderson, T. J. C. & Curiel, T. J., 1 Jun 2011, In : Experimental Parasitology. 128, 2, p. 170-175 6 p.

Research output: Contribution to journalArticle

17 Scopus citations

Laboratory analysis of vitamin C in vegetables served in eldercare facilities and evaluation of related public nutrient database information

Konas, D. W., Feldman, C., Anand, B., Piemonte, J., Garay, C., Silverthorne, E. & Wunderlich, S. M., 1 Jan 2011, In : Topics in Clinical Nutrition. 26, 1, p. 68-77 10 p.

Research output: Contribution to journalArticle

1 Scopus citations

Laser-induced acoustic desorption/ atmospheric pressure chemical ionization mass spectrometry

Gao, J., Borton, D. J., Owen, B. C., Jin, Z., Hurt, M., Amundson, L. M., Madden, J. T., Qian, K. & Kenttämaa, H. I., 1 Mar 2011, In : Journal of the American Society for Mass Spectrometry. 22, 3, p. 531-538 8 p.

Research output: Contribution to journalArticle

21 Scopus citations

Prediction of residues involved in inhibitor specificity in the dihydrofolate reductase family

Goodey, N. M., Herbert, K. G., Hall, S. M. & Bagley, K. C., 1 Dec 2011, In : Biochimica et Biophysica Acta - Proteins and Proteomics. 1814, 12, p. 1870-1879 10 p.

Research output: Contribution to journalArticle

6 Scopus citations

The role of a Brugia malayi p38 MAP kinase ortholog (Bm-MPK1) in parasite anti-oxidative stress responses

Patel, A., Chojnowski, A. N., Gaskill, K., De Martini, W., Goldberg, R. L. & Siekierka, J. J., 1 Apr 2011, In : Molecular and Biochemical Parasitology. 176, 2, p. 90-97 8 p.

Research output: Contribution to journalArticle

11 Scopus citations

The synthesis and cyclic voltammetry of select ferrocene piano-stool isocyanide complexes

Humphrey, B. D., Castilo, R. E., Vega, A. H., Feliciano, A. & Squires, M. E., 15 Mar 2011, In : Inorganica Chimica Acta. 368, 1, p. 271-274 4 p.

Research output: Contribution to journalArticle

2 Scopus citations
2010

A 1,1′-ferrocenyl phosphine-borane: Synthesis, structure and evaluation in Rh-catalyzed hydroformylation

Bebbington, M. W. P., Bontemps, S., Bouhadir, G., Hanton, M. J., Tooze, R. P., Van Rensburg, H. & Bourissou, D., 1 Aug 2010, In : New Journal of Chemistry. 34, 8, p. 1556-1559 4 p.

Research output: Contribution to journalArticle

39 Scopus citations
23 Scopus citations
146 Scopus citations

Formation of highly stable dispersions of silane-functionalized reduced graphene oxide

Hou, S., Su, S., Kasner, M. L., Shah, P., Patel, K. & Madarang, C. J., 6 Dec 2010, In : Chemical Physics Letters. 501, 1-3, p. 68-74 7 p.

Research output: Contribution to journalArticle

156 Scopus citations