Aaron Scheinberg

Supercomputer-Based Ensemble Docking Drug Discovery Pipeline with Application to Covid-19

Atanu Acharya, Rupesh Agarwal, Matthew Baker et al. · Journal of Chemical Information and Modeling · 2020 · 185 citations · Full text

Artificial Intelligence, Drug Target, Engineering +19

Orb5: A global electromagnetic gyrokinetic code using the PIC approach in toroidal geometry

Emmanuel Lanti, N. Ohana, N. Tronko et al. · Computer Physics Communications · 2019 · 121 citations · Full text

Physics, Geometry, Twistor Theory +3

Magnetic field generation in the lunar core: The role of inner core growth

Aaron Scheinberg, K. M. Soderlund, G. Schubert · Icarus · 2015 · 61 citations

Inner Core Growth, Planetary Interior, Lunar Core +7

Core solidification and dynamo evolution in a mantle‐stripped planetesimal

Aaron Scheinberg, L. T. Elkins‐Tanton, G. Schubert et al. · Journal of Geophysical Research Planets · 2015 · 51 citations · Full text

Planetary Interior, Core Solidification, Engineering +9

GPU-Accelerated Drug Discovery with Docking on the Summit Supercomputer

Scott LeGrand, Aaron Scheinberg, Andreas F. Tillack et al. · 2020 · 51 citations · Full text

Engineering, Hit Identification, Molecular Biology +17