Jan 1, 2026
GPU-Accelerated DEGAUSS in AMBER for Molecular Dynamics and Alchemical Free-Energy Calculations
GPU implementation of DEGAUSS in AMBER for molecular dynamics and alchemical free-energy calculations. Manuscript submitted, 2026.
Zhen Huang / Research
Jan 1, 2026
GPU implementation of DEGAUSS in AMBER for molecular dynamics and alchemical free-energy calculations. Manuscript submitted, 2026.