The pmemd.cuda GPU Implementation

The pmemd.cuda GPU Implementation

GPU-Accelerated Implementation of Continuous Constant pH Molecular Dynamics in Amber: pKa Predictions with Single-pH Simulations

Biomolecules, Free Full-Text

Automated docking refinement and virtual compound screening with absolute binding free energy calculations

Full article: Solvated and generalised Born calculations differences using GPU CUDA and multi-CPU simulations of an antifreeze protein with AMBER

AMBER14 & GPUs

Running AMBER on a GPU Cluster - Microway

GUI and output for statistical comparison of dynamic motion

The pmemd.cuda GPU Implementation

The pmemd.cuda GPU Implementation

Accelerators for Classical Molecular Dynamics Simulations of Biomolecules

The pmemd.cuda GPU Implementation

Automated docking refinement and virtual compound screening with absolute binding free energy calculations