Researcher interests: Many-body Brownian dynamics simulations. Reversible diffusion-influenced reactions. Ligand binding to heme proteins. Excited-state proton transfer. Proton mobility. Water structure and dynamics. Proton-wires in proteins. Prehistory of Semitic languages.
FACULTY / SCHOOL: Faculty of Science
DEPARTMENT: The Institute of Chemistry
Selected Publications
thermally induced hydrogen bond rearrangements in small water clusters and the persistent water tetramer (2019)|
ACS Omega|
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temperature dependence of intramolecular vibrational bands in small water clusters (2019)|
Journal of Physical Chemistry B|
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ionic radii of hydrated sodium cation from qtaim (2019)|
Journal of Chemical Physics|
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the protonated water trimer and its giant fermi resonances (2018)|
Chemical Physics|
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structure spectroscopy and dynamics of the phenol water 2 cluster at low and high temperatures (2017)|
Journal of Chemical Physics|
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origin of proton affinity to membrane water interfaces (2017)|
Scientific Reports|
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isoelectronic theory for cationic radii (2017)|
Journal of the American Chemical Society|
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charge transfer in proteins in celebration of hemi gutman s 80 th birthday (2017)|
Israel Journal of Chemistry|
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reinvestigation of the infrared spectrum of the gas phase protonated water tetramer (2017)|
Journal of Physical Chemistry A|
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proton wire dynamics in the green fluorescent protein (2017)|
Journal of Chemical Theory and Computation|
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