| Water determines the structure and dynamics of proteins MC Bellissent-Funel, A Hassanali, M Havenith, R Henchman, P Pohl, ... Chemical reviews 116 (13), 7673-7697, 2016 | 856 | 2016 |
| Modeling molecular interactions in water: From pairwise to many-body potential energy functions GA Cisneros, KT Wikfeldt, L Ojamäe, J Lu, Y Xu, H Torabifard, AP Bartók, ... Chemical reviews 116 (13), 7501-7528, 2016 | 434 | 2016 |
| Long-range protein–water dynamics in hyperactive insect antifreeze proteins K Meister, S Ebbinghaus, Y Xu, JG Duman, A DeVries, M Gruebele, ... Proceedings of the National Academy of Sciences 110 (5), 1617-1622, 2013 | 297 | 2013 |
| Perspective: Watching low-frequency vibrations of water in biomolecular recognition by THz spectroscopy Y Xu, M Havenith The Journal of Chemical Physics 143 (17), 170901, 2015 | 134 | 2015 |
| Dynamics of water clusters confined in proteins: a molecular dynamics simulation study of interfacial waters in a dimeric hemoglobin R Gnanasekaran, Y Xu, DM Leitner The Journal of Physical Chemistry B 114 (50), 16989-16996, 2010 | 62 | 2010 |
| Vibrational energy flow through the green fluorescent protein–water interface: communication maps and thermal boundary conductance Y Xu, DM Leitner The Journal of Physical Chemistry B 118 (28), 7818-7826, 2014 | 52 | 2014 |
| Temperature-and mechanical-force-responsive self-assembled rhomboidal metallacycle Z Chen, JH Tang, W Chen, Y Xu, H Wang, Z Zhang, H Sepehrpour, ... Organometallics 38 (21), 4244-4249, 2019 | 37 | 2019 |
| Vibrational energy flow across heme–cytochrome c and cytochrome c–water interfaces JK Agbo, Y Xu, P Zhang, JE Straub, DM Leitner Gregory S. Ezra: A Festschrift from Theoretical Chemistry Accounts, 129-138, 2015 | 37 | 2015 |
| Analysis of water and hydrogen bond dynamics at the surface of an antifreeze protein Y Xu, R Gnanasekaran, DM Leitner Journal of Atomic and Molecular Physics 2012 (1), 125071, 2012 | 36 | 2012 |
| The role of sulfates on antifreeze protein activity K Meister, JG Duman, Y Xu, AL DeVries, DM Leitner, M Havenith The Journal of Physical Chemistry B 118 (28), 7920-7924, 2014 | 31 | 2014 |
| Protein–water dynamics in antifreeze protein III activity Y Xu, A Bäumer, K Meister, CG Bischak, AL DeVries, DM Leitner, ... Chemical Physics Letters 647, 1-6, 2016 | 29 | 2016 |
| Local chemistry of the surfactant's head groups determines protein stability in reverse micelles M Senske, Y Xu, A Bäumer, S Schäfer, H Wirtz, J Savolainen, ... Physical Chemistry Chemical Physics 20 (13), 8515-8522, 2018 | 28 | 2018 |
| Hydrophobic collapse induces changes in the collective protein and hydration low frequency modes TQ Luong, Y Xu, E Bründermann, DM Leitner, M Havenith Chemical Physics Letters 651, 1-7, 2016 | 24 | 2016 |
| Communication maps of vibrational energy transport through Photoactive Yellow Protein Y Xu, DM Leitner The Journal of Physical Chemistry A 118 (35), 7280-7287, 2014 | 22 | 2014 |
| The dielectric response to photoexcitation of GFP: A molecular dynamics study Y Xu, R Gnanasekaran, DM Leitner Chemical Physics Letters 564, 78-82, 2013 | 16 | 2013 |
| Highly efficient ion sieving through angstrom-scale channels embedded with supramolecular coordination complexes RH Li, SQ Cheng, Z Chen, Y Xu, P Liu, YJ Liu, Y Sun, Y Liu Cell Reports Physical Science 4 (5), 2023 | 3 | 2023 |
| Understanding the Energetic Components Influencing the Thermodynamic Quantities of Carbonic Anhydrase Protein upon Ligand Binding R Gnanasekaran, Y Xu ChemistrySelect 7 (8), e202200024, 2022 | 1 | 2022 |
| Computational exploration of copper catalyzed vinylogous aerobic oxidation of unsaturated compounds T Wang, Y Zhou, Y Xu, GJ Cheng Scientific Reports 11 (1), 1304, 2021 | 1 | 2021 |
| Molecular dynamics simulation studies of dielectric response and vibrational energy relaxation in photoactive yellow protein and green fluorescent protein Y Xu, R Gnanasekaran, D Leitner APS March Meeting Abstracts 2012, V41. 010, 2012 | | 2012 |
| Computational study of the first few picoseconds following photoexcitation of GFP Y Xu, R Gnanasekaran, DM Leitner ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 241, 2011 | | 2011 |
David LeitnerDepartment of Chemistry, University of Nevada, RenoVerified email at unr.edu