Amber 20.9-AmberTools-20.14-foss-2020a-Python-3.8.2
Deprecated: Use of this version of Amber is deprecated. More information on our Applications Support and Retention Policy.
There is a newer version of Amber
Amber (originally Assisted Model Building with Energy Refinement) is software for performing molecular dynamics and structure prediction.Accessing Amber 20.9-AmberTools-20.14-foss-2020a-Python-3.8.2
To load the module for Amber 20.9-AmberTools-20.14-foss-2020a-Python-3.8.2 please use this command on the BEAR systems (BlueBEAR, BEAR Cloud VMs, and CaStLeS VMs):
module load Amber/20.9-AmberTools-20.14-foss-2020a-Python-3.8.2
BEAR Apps Version
More Information
For more information visit the Amber website.
Dependencies
This version of Amber has a direct dependency on: Boost.Python/1.72.0-gompi-2020a bzip2/1.0.8-GCCcore-9.3.0 foss/2020a libreadline/8.0-GCCcore-9.3.0 matplotlib/3.2.1-foss-2020a-Python-3.8.2 netCDF/4.7.4-gompi-2020a netCDF-Fortran/4.5.2-gompi-2020a Perl/5.30.2-GCCcore-9.3.0 PnetCDF/1.12.1-gompi-2020a Python/3.8.2-GCCcore-9.3.0 SciPy-bundle/2020.03-foss-2020a-Python-3.8.2 Tkinter/3.8.2-GCCcore-9.3.0 X11/20200222-GCCcore-9.3.0 zlib/1.2.11-GCCcore-9.3.0
Other Versions
These versions of Amber are available on the BEAR systems (BlueBEAR, BEAR Cloud VMs, and CaStLeS VMs). These will be retained in accordance with our Applications Support and Retention Policy.
Last modified on 9th February 2021