| Comprehensive theoretical study of the conversion reactions of spiropyrans: substituent and solvent effects Y Sheng, J Leszczynski, AA Garcia, R Rosario, D Gust, J Springer The Journal of Physical Chemistry B 108 (41), 16233-16243, 2004 | 213 | 2004 |
| Formation of a β-pyrimidine nucleoside by a free pyrimidine base and ribose in a plausible prebiotic reaction HD Bean, Y Sheng, JP Collins, FAL Anet, J Leszczynski, NV Hud Journal of the American Chemical Society 129 (31), 9556-9557, 2007 | 92 | 2007 |
| Computational studies of tungsten-catalyzed endo-selective cycloisomerization of 4-pentyn-1-ol Y Sheng, DG Musaev, KS Reddy, FE McDonald, K Morokuma Journal of the American Chemical Society 124 (15), 4149-4157, 2002 | 73 | 2002 |
| Light‐induced cytotoxicity of 16 polycyclic aromatic hydrocarbons on the US EPA priority pollutant list in human skin HaCaT keratinocytes: relationship between phototoxicity … S Wang, Y Sheng, M Feng, J Leszczynski, L Wang, H Tachikawa, H Yu Environmental Toxicology: An International Journal 22 (3), 318-327, 2007 | 60 | 2007 |
| AM1 study of the relationship between the donor–acceptor strength and the polarizabilities of push–pull polyenes Y Sheng, Y Jiang, XC Wang Journal of the Chemical Society, Faraday Transactions 94 (1), 47-52, 1998 | 41 | 1998 |
| Comprehensive investigation of the energetics of pyrimidine nucleoside formation in a model prebiotic reaction Y Sheng, HD Bean, I Mamajanov, NV Hud, J Leszczynski Journal of the American Chemical Society 131 (44), 16088-16095, 2009 | 37 | 2009 |
| Neutral hydrolyses of carbon disulfide: An ab initio study of water catalysis C Deng, XP Wu, XM Sun, Y Ren, YH Sheng Journal of computational chemistry 30 (2), 285-294, 2009 | 34 | 2009 |
| The Molecular Structures, Energetics, and Nature of Interactions in Arn-N2H+ (n = 1−12) Complexes Y Sheng, RW Gora, S Roszak, M Kaczorowska, J Leszczynski The Journal of Physical Chemistry A 106 (46), 11162-11167, 2002 | 19 | 2002 |
| Insight into structural rearrangements and interdomain interactions related to electron transfer between flavin mononucleotide and heme in nitric oxide synthase: A molecular … Y Sheng, L Zhong, D Guo, G Lau, C Feng Journal of inorganic biochemistry 153, 186-196, 2015 | 18 | 2015 |
| Ionic liquids with thioether motifs as synthetic cationic lipids for gene delivery JC Gaitor, LM Paul, MM Reardon, T Hmissa, S Minkowicz, M Regner, ... Chemical communications 53 (59), 8328-8331, 2017 | 17 | 2017 |
| AM1/CI study of the first-order hyperpolarizability for push–pull quinones and push–pull polyenes A two-level model evaluation Y Sheng, Y Jiang Journal of the Chemical Society, Faraday Transactions 94 (13), 1823-1828, 1998 | 17 | 1998 |
| Chiral CE separation of dopamine-derived neurotoxins Z Quan, Y Song, G Peters, M Shenwu, Y Sheng, HM Hwang, YM Liu Analytical sciences 21 (2), 115-119, 2005 | 15 | 2005 |
| Design principles of lipid-like ionic liquids for gene delivery DJ Siegel, GI Anderson, LM Paul, PJ Seibert, PC Hillesheim, Y Sheng, ... ACS applied bio materials 4 (6), 4737-4743, 2021 | 13 | 2021 |
| Thermal racemization of spiropyrans: implication of substituent and solvent effects revealed by computational study Y Sheng, J Leszczynski Structural chemistry 25, 667-677, 2014 | 13 | 2014 |
| A Comprehensive Computational Study of N2H+−X (X = He, Ne, Ar, Kr, Xe, and H2) Complexes Y Sheng, J Leszczynski The Journal of Physical Chemistry A 106 (50), 12095-12102, 2002 | 12 | 2002 |
| Polarizability and hyperpolarizability of push–pull quinoid molecules Simulation of donor–acceptor pairs Y Sheng, Y Jiang Journal of the Chemical Society, Faraday Transactions 94 (13), 1829-1833, 1998 | 12 | 1998 |
| Computational Study on a HS– Sensing Reaction Utilizing a Pyrylium Derivative Y Sheng, Y Ren The Journal of Physical Chemistry A 116 (22), 5420-5427, 2012 | 11 | 2012 |
| Theoretical Studies on Alkyne Addition to Molybdenum Alkylidenes: The Preference of α-and β-Additions YH Sheng, YD Wu Journal of the American Chemical Society 123 (27), 6662-6668, 2001 | 11 | 2001 |
| Phosphorodithioate-functionalized ionic liquids: Synthesis and physicochemical properties characterization Z Shultz, JC Gaitor, RD Burton, M Regner, Y Sheng, A Mirjafari Journal of molecular liquids 276, 334-337, 2019 | 8 | 2019 |
| Determination of derivatized urea in exhaled breath condensate by LC-MS Z Quan, C Purser, RC Baker, T Dwyer, R Bhagat, Y Sheng, ... Journal of chromatographic science 48 (2), 140-144, 2010 | 8 | 2010 |
