Free Energies of Hydrated Halide Anions: High Through-Put Computations on Clusters to Treat Rough Energy-Landscapes Journal May, 2021
Molecular basis for higher affinity of SARS-CoV-2 spike RBD for human ACE2 receptor Journal April, 2021
A DG-IMEX Method for Two-moment Neutrino Transport: Nonlinear Solvers for Neutrino–Matter Coupling Journal April, 2021
A high-order WENO-limited finite-volume algorithm for atmospheric flow using the ADER-differential transform time discretization Journal March, 2021
Monte Carlo simulation of order-disorder transition in refractory high entropy alloys: A data-driven approach Journal February, 2021
