The pmemd.cuda GPU Implementation

Amber (PMEMD) GPU Support

Statistical machine learning for comparative protein dynamics with the DROIDS/maxDemon software pipeline - ScienceDirect

Routine Microsecond Molecular Dynamics Simulations with AMBER on GPUs. 1. Generalized Born

TI Calculation with DDBoost

Accelerators for Classical Molecular Dynamics Simulations of Biomolecules

CUDA kernels in python

The pmemd.cuda GPU Implementation

Fast and Flexible GPU Accelerated Binding Free Energy Calculations within the AMBER Molecular Dynamics Package

The pmemd.cuda GPU Implementation

GPU-Accelerated All-Atom Particle-Mesh Ewald Continuous Constant pH Molecular Dynamics in Amber