amber¶
Description¶
Amber is a suite of biomolecular simulation programs together with Amber tools. A manual download is required for Ambers. Spack will search your current directory for the download files. Alternatively, add the files to a mirror so that Spack can find them. For instructions on how to set up a mirror, see https://spack.readthedocs.io/en/latest/mirrors.html Note: Only certain versions of ambertools are compatible with amber. Only the latter version of ambertools for each amber version is supported.
Homepage¶
Available Versions on RCAC Clusters¶
| Cluster | Versions |
|---|---|
| ANVIL | 20, 24 |
| BELL | 24 |
| GAUTSCHI | 24 |
| GILBRETH | 24 |
| NEGISHI | 20, 24 |
| SCHOLAR | 24 |
Module¶
You can load the module by:
Note for using amber
Run module spider amber beforehand to check if this version requires any prerequisite modules.