Amber

Owned by Simon Alexander, created
May 22, 2024
1 min read
1 Overview | 2 Using | 2.1 Multicore

Overview

  • Amber: is a suite of biomolecular simulation programs.

Using

Use the module name amber to discover versions available and to load the application.

Multicore

The amber application has been build with OpenMP, MPI and CUDA - there are 10s of different commands, using a different combination of functionality. Users will need to look at a commands help, or the reference manual to find out what functionality the command uses.

Users can provide us with details and examples that we can add to this page to share with the wider community.