Monthly Archives: November 2010

High Throughput Parallel Molecular Dynamics on OSG

The Goal RENCI’s working with researchers interested in running high throughput parallel molecular dynamics simulations on OSG. Amber9 PMEMD The program we’d like to execute is called PMEMD (Particle Mesh Ewald Molecular Dynamics). PMEMD is a high-performance, parallel component of … Continue reading

Posted in Amber9, Compute Grids, condor, Continuous Integration (CI), Engage VO, grid, High Throughput Computing (HTC), High Throughput Parallel Computing (HTPC), multicore, OSG, pmemd, RENCI | Leave a comment