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Lu Wang, Ph.D - Publications

Affiliations: 
Chemistry and Chemical Biology Rutgers University, New Brunswick, New Brunswick, NJ, United States 
Area:
Biophysical and computational chemistry
Website:
http://www.sas.rutgers.edu/cms/wanggroup/
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20 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2021 Baiz CR, Błasiak B, Bredenbeck J, Cho M, Choi JH, Corcelli SA, Dijkstra AG, Feng CJ, Garrett-Roe S, Ge NH, Hanson-Heine MWD, Hirst JD, Jansen TLC, Kwac K, Kubarych KJ, ... ... Wang L, et al. Correction to Vibrational Spectroscopic Map, Vibrational Spectroscopy, and Intermolecular Interaction. Chemical Reviews. PMID 34709802 DOI: 10.1021/acs.chemrev.1c00758  0.588
2020 Meng W, Jiang Y, Rothschild D, Lipke M, Hall G, Wang L. Modeling the structure and infrared spectra of omega-3 fatty acid esters. The Journal of Chemical Physics. 153: 035101. PMID 32716186 DOI: 10.1063/5.0015402  0.536
2020 Baiz CR, Błasiak B, Bredenbeck J, Cho M, Choi JH, Corcelli SA, Dijkstra AG, Feng CJ, Garrett-Roe S, Ge NH, Hanson-Heine MWD, Hirst JD, Jansen TLC, Kwac K, Kubarych KJ, ... ... Wang L, et al. Vibrational Spectroscopic Map, Vibrational Spectroscopy, and Intermolecular Interaction. Chemical Reviews. PMID 32598850 DOI: 10.1021/Acs.Chemrev.9B00813  0.58
2020 Jiang Y, Wang L. Modeling the vibrational couplings of nucleobases. The Journal of Chemical Physics. 152: 084114. PMID 32113367 DOI: 10.1063/1.5141858  0.537
2020 Wang L, Ceriotti M, Markland TE. Quantum kinetic energy and isotope fractionation in aqueous ionic solutions. Physical Chemistry Chemical Physics : Pccp. PMID 31942581 DOI: 10.1039/C9Cp06483D  0.601
2019 Jiang Y, Wang L. Development of Vibrational Frequency Maps for Nucleobases. The Journal of Physical Chemistry. B. PMID 31260308 DOI: 10.1021/Acs.Jpcb.9B04633  0.534
2017 Wang L, Fried SD, Markland TE. Proton Network Flexibility Enables Robustness and Large Electric Fields in the Ketosteroid Isomerase Active Site. The Journal of Physical Chemistry. B. PMID 28915043 DOI: 10.1021/Acs.Jpcb.7B06985  0.603
2016 Wang L, Isborn CM, Markland TE. Simulating Nuclear and Electronic Quantum Effects in Enzymes. Methods in Enzymology. 577: 389-418. PMID 27498646 DOI: 10.1016/Bs.Mie.2016.05.047  0.601
2016 Kelly A, Montoya-Castillo A, Wang L, Markland TE. Generalized quantum master equations in and out of equilibrium: When can one win? The Journal of Chemical Physics. 144: 184105. PMID 27179469 DOI: 10.1063/1.4948612  0.767
2016 Yan C, Yuan R, Pfalzgraff WC, Nishida J, Wang L, Markland TE, Fayer MD. Unraveling the dynamics and structure of functionalized self-assembled monolayers on gold using 2D IR spectroscopy and MD simulations. Proceedings of the National Academy of Sciences of the United States of America. PMID 27044113 DOI: 10.1073/Pnas.1603080113  0.757
2015 Carr JK, Wang L, Roy S, Skinner JL. Theoretical Sum Frequency Generation Spectroscopy of Peptides. The Journal of Physical Chemistry. B. 119: 8969-83. PMID 25203677 DOI: 10.1021/Jp507861T  0.621
2014 Wang L, Fried SD, Boxer SG, Markland TE. Quantum delocalization of protons in the hydrogen-bond network of an enzyme active site. Proceedings of the National Academy of Sciences of the United States of America. 111: 18454-9. PMID 25503367 DOI: 10.1073/Pnas.1417923111  0.601
2014 Wang L, Ceriotti M, Markland TE. Quantum fluctuations and isotope effects in ab initio descriptions of water. The Journal of Chemical Physics. 141: 104502. PMID 25217932 DOI: 10.1063/1.4894287  0.596
2014 Wang L, Fried SD, Wu Y, Boxer SG, Markland TE. Quantum Delocalization of Protons in the Ketosteroid Isomerase Active Site Biophysical Journal. 106: 589a. DOI: 10.1016/J.Bpj.2013.11.3263  0.758
2012 Woys AM, Almeida AM, Wang L, Chiu CC, McGovern M, de Pablo JJ, Skinner JL, Gellman SH, Zanni MT. Parallel β-sheet vibrational couplings revealed by 2D IR spectroscopy of an isotopically labeled macrocycle: quantitative benchmark for the interpretation of amyloid and protein infrared spectra. Journal of the American Chemical Society. 134: 19118-28. PMID 23113791 DOI: 10.1021/Ja3074962  0.582
2012 Wang L, Skinner JL. Thermally induced protein unfolding probed by isotope-edited IR spectroscopy. The Journal of Physical Chemistry. B. 116: 9627-34. PMID 22853174 DOI: 10.1021/Jp304613B  0.428
2011 Wang L, Middleton CT, Singh S, Reddy AS, Woys AM, Strasfeld DB, Marek P, Raleigh DP, de Pablo JJ, Zanni MT, Skinner JL. 2DIR spectroscopy of human amylin fibrils reflects stable β-sheet structure. Journal of the American Chemical Society. 133: 16062-71. PMID 21916515 DOI: 10.1021/Ja204035K  0.586
2011 Wang L, Middleton CT, Zanni MT, Skinner JL. Development and validation of transferable amide I vibrational frequency maps for peptides. The Journal of Physical Chemistry. B. 115: 3713-24. PMID 21405034 DOI: 10.1021/Jp200745R  0.574
2010 Reddy AS, Wang L, Singh S, Ling YL, Buchanan L, Zanni MT, Skinner JL, de Pablo JJ. Stable and metastable states of human amylin in solution. Biophysical Journal. 99: 2208-16. PMID 20923655 DOI: 10.1016/J.Bpj.2010.07.014  0.579
2010 Reddy AS, Wang L, Lin YS, Ling Y, Chopra M, Zanni MT, Skinner JL, De Pablo JJ. Solution structures of rat amylin peptide: simulation, theory, and experiment. Biophysical Journal. 98: 443-51. PMID 20141758 DOI: 10.1016/J.Bpj.2009.10.029  0.66
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