/tag/lmod
GPU-enabled Software and UVA HPC
Please note that certain modules can only run on specific GPU types. This will be displayed in a message upon loading the module.
Certain software applications may also able to take advantage of the advanced capabilities provided by the NVIDIA DGX BasePOD™.
Learn More function searchFunction() { var input, filter, table, tr, td, i, txtValue; input = document.getElementById(“searchInput”); filter = input.value.toUpperCase(); table = document.getElementById(“moduleTable”); tr = table.getElementsByTagName(“tr”); for (i = 0; i -1) { tr[i].style.display = “"; } else { tr[i].style.display = “none”; } } } } Module Category Description alphafold bio gpu Open source code for AlphaFold amber chem gpu Amber (originally Assisted Model Building with Energy Refinement) is software for performing molecular dynamics and structure prediction.
Software Modules
The lmod modules system on the HPC system enables users to easily set their environments for selected software and to choose versions if appropriate.
The lmod system is hierarchical; not every module is available in every environment. We provide a core environment which contains most of the software installed by Research Computing staff, but software that requires a compiler or MPI is not in that environment and a compiler must first be loaded.
View All Modules Basic Commands List all available software
module avail $('#copybtn759341826').click(function(){ var $temp = $(""); $(“body”).append($temp); $temp.val($('#759341826').text()).select(); document.execCommand(“copy”); $temp.
UVA HPC Software List
function searchFunction() { var input, filter, table, tr, td, i, txtValue; input = document.getElementById(“searchInput”); filter = input.value.toUpperCase(); table = document.getElementById(“moduleTable”); tr = table.getElementsByTagName(“tr”); for (i = 0; i -1) { tr[i].style.display = “"; } else { tr[i].style.display = “none”; } } } } Module Category Description R lang R is a free software environment for statistical computing and graphics. abinit chem ABINIT is a package whose main program allows one to find the total energy, charge density and electronic structure of systems made of electrons and nuclei (molecules and periodic solids) within Density Functional Theory (DFT), using pseudopotentials and a planewave or wavelet basis.
