39 citations · 167 across the 16 of their papers we have counts for
3 papers · 1 filter
High-Throughput Virtual Screening of Small Molecule Inhibitors for SARS-CoV-2 Protein Targets with Deep Fusion Models
Garrett A. Stevenson, Derek Jones, Hyojin Kim +29
Structure-based Deep Fusion models were recently shown to outperform several physics- and machine learning-based protein-ligand binding affinity prediction methods. As part of a mu…
Dynamics of Laterally Propagating Flames in X-ray Bursts. II. Realistic Burning & Rotation
A. Harpole, N. M. Ford, K. Eiden +4
We continue to investigate two-dimensional laterally propagating flames in type I X-ray bursts using fully compressible hydrodynamics simulations. In the current study we relax pre…
Practical Effects of Integrating Temperature with Strang Split Reactions
M. Zingale, M. P. Katz, D. E. Willcox +1
For astrophysical reacting flows, operator splitting is commonly used to couple hydrodynamics and reactions. Each process operates independent of one another, but by staggering the…