LAMMPS Patch Release 9 October 2020
LAMMPS Patch Release Overview What is LAMMPS used for? LAMMPS is a classical molecular dynamics (MD) code that models ensembles of particles in a liquid, solid, or gaseous state. It…
NVIDIA Ampere GPUs Smash HPC Benchmarks for AMBER 20 – RTX 3090 vs RTX 3080 vs A100 vs RTX 6000 vs RTX 2080 Ti
AMBER 20 GPU Benchmarks for Molecular Dynamics **10/20/2020 UPDATED with NVIDIA RTX 3080** The following Amber 20 Benchmarks were performed on an Exxact AMBER Certified MD System using the following GPUs…
LAMMPS Patch Release 18 September 2020
LAMMPS Patch Release Overview What is LAMMPS used for? LAMMPS is a classical molecular dynamics (MD) code that models ensembles of particles in a liquid, solid, or gaseous state. It…
NAMD 2.14 Release August 2020
New NAMD 2.14 Release NAMD Release Overview What is NAMD? NAMD is a parallel molecular dynamics code designed for high-performance simulation of large biomolecular systems. Based on Charm++ parallel objects,…
LAMMPS Patch Release 21 August 2020
LAMMPS Patch Release Overview What is LAMMPS used for? LAMMPS is a classical molecular dynamics (MD) code that models ensembles of particles in a liquid, solid, or gaseous state. It…