| 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 | 606 | 2016 |
| Protons and hydroxide ions in aqueous systems N Agmon, HJ Bakker, RK Campen, RH Henchman, P Pohl, S Roke, ... Chemical reviews 116 (13), 7642-7672, 2016 | 369 | 2016 |
| Proton transfer through the water gossamer A Hassanali, F Giberti, J Cuny, TD Kühne, M Parrinello Proceedings of the National Academy of Sciences 110 (34), 13723-13728, 2013 | 356 | 2013 |
| Hydration dynamics and time scales of coupled water− protein fluctuations T Li, AA Hassanali, YT Kao, D Zhong, SJ Singer Journal of the American Chemical Society 129 (11), 3376-3382, 2007 | 269 | 2007 |
| On the recombination of hydronium and hydroxide ions in water A Hassanali, MK Prakash, H Eshet, M Parrinello Proceedings of the National Academy of Sciences 108 (51), 20410-20415, 2011 | 186 | 2011 |
| Proton transfer and structure-specific fluorescence in hydrogen bond-rich protein structures D Pinotsi, L Grisanti, P Mahou, R Gebauer, CF Kaminski, A Hassanali, ... Journal of the American Chemical Society 138 (9), 3046-3057, 2016 | 171 | 2016 |
| Model for the water− amorphous silica interface: the undissociated surface AA Hassanali, SJ Singer The Journal of Physical Chemistry B 111 (38), 11181-11193, 2007 | 157 | 2007 |
| Aqueous solutions: state of the art in ab initio molecular dynamics AA Hassanali, J Cuny, V Verdolino, M Parrinello Philosophical Transactions of the Royal Society A: Mathematical, Physical …, 2014 | 149 | 2014 |
| Anomalous water diffusion in salt solutions Y Ding, AA Hassanali, M Parrinello Proceedings of the National Academy of Sciences 111 (9), 3310-3315, 2014 | 129 | 2014 |
| DNA binding to the silica surface B Shi, YK Shin, AA Hassanali, SJ Singer The Journal of Physical Chemistry B 119 (34), 11030-11040, 2015 | 103 | 2015 |
| The water–amorphous silica interface: analysis of the Stern layer and surface conduction H Zhang, AA Hassanali, YK Shin, C Knight, SJ Singer The Journal of chemical physics 134 (2), 024705, 2011 | 88 | 2011 |
| Decomposition of the experimental Raman and infrared spectra of acidic water into proton, special pair, and counterion contributions CA Daly Jr, LM Streacker, Y Sun, SR Pattenaude, AA Hassanali, ... The journal of physical chemistry letters 8 (21), 5246-5252, 2017 | 86 | 2017 |
| Structure and dynamics of the instantaneous water/vapor interface revisited by path-integral and ab initio molecular dynamics simulations J Kessler, H Elgabarty, T Spura, K Karhan, P Partovi-Azar, AA Hassanali, ... The Journal of Physical Chemistry B 119 (31), 10079-10086, 2015 | 70 | 2015 |
| The role of quantum effects on structural and electronic fluctuations in neat and charged water F Giberti, AA Hassanali, M Ceriotti, M Parrinello The Journal of Physical Chemistry B 118 (46), 13226-13235, 2014 | 63 | 2014 |
| Origin of slow relaxation following photoexcitation of W7 in myoglobin and the dynamics of its hydration layer T Li, AA Hassanali, SJ Singer The Journal of Physical Chemistry B 112 (50), 16121-16134, 2008 | 61 | 2008 |
| The dissociated amorphous silica surface: Model development and evaluation AA Hassanali, H Zhang, C Knight, YK Shin, SJ Singer Journal of chemical theory and computation 6 (11), 3456-3471, 2010 | 60 | 2010 |
| The fuzzy quantum proton in the hydrogen chloride hydrates AA Hassanali, J Cuny, M Ceriotti, CJ Pickard, M Parrinello Journal of the American Chemical Society 134 (20), 8557-8569, 2012 | 56 | 2012 |
| Charge transfer as a ubiquitous mechanism in determining the negative charge at hydrophobic interfaces E Poli, KH Jong, A Hassanali Nature communications 11 (1), 901, 2020 | 55 | 2020 |
| Thermal transport at a nanoparticle-water interface: A molecular dynamics and continuum modeling study A Rajabpour, R Seif, S Arabha, MM Heyhat, S Merabia, A Hassanali The Journal of chemical physics 150 (11), 114701, 2019 | 55 | 2019 |
| A molecular dynamics study of Lys-Trp-Lys: structure and dynamics in solution following photoexcitation AA Hassanali, T Li, D Zhong, SJ Singer The Journal of Physical Chemistry B 110 (21), 10497-10508, 2006 | 54 | 2006 |
michele parrinelloDepartment of ChemistryVerified email at phys.chem.ethz.ch
