40 citations · 123 across the 10 of their papers we have counts for
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physics.chem-ph2018★ 15 cited
Proton-transfer induced fluorescence in self assembled short peptides
Sijo K. Joseph, Natalia Kuritz, Eldad Yahel +3
We employ Molecular Dynamics (MD) and Time-Dependent Density Functional Theory (TDDFT) to explore the fluorescence of Hydrogen-bonded dimer and trimer structures of Cyclic FF (Phe-…
physics.chem-ph2018★ 19 cited
Size and Temperature Transferability of Direct and Local Deep Neural Networks for Atomic Forces
Natalia Kuritz, Goren Gordon, Amir Natan
A direct and local deep learning (DL) model for atomic forces is presented. We demonstrate the model performance in bulk aluminum, sodium, and silicon; and show that its errors are…