From 7022dd09abce71d4b5e9261d2b7ae8934436fbf7 Mon Sep 17 00:00:00 2001 From: John LaGrone Date: Mon, 30 Mar 2026 13:02:47 -0500 Subject: [PATCH] update module file --- modules/mp/apps/deepmd-kit/3.1.3.lua | 12 ------------ 1 file changed, 12 deletions(-) diff --git a/modules/mp/apps/deepmd-kit/3.1.3.lua b/modules/mp/apps/deepmd-kit/3.1.3.lua index 6ab4b69f..702ca317 100644 --- a/modules/mp/apps/deepmd-kit/3.1.3.lua +++ b/modules/mp/apps/deepmd-kit/3.1.3.lua @@ -1,19 +1,7 @@ whatis("DeePMD-kit 3.1.2") family("lammps") -prepend_path("MODULEPATH", "/hpc/mp/spack_modules/linux-ubuntu22.04-zen2") - -load("gcc/13.2.0") -load("cuda/12.8.0-6mc4fti") -load("nccl/2.22.3-1-lkmfvs4") load("miniforge/24.11.2-1") - - -prepend_path("PATH", "/hpc/mp/apps/deepmd-kit/2026-03-20/deepmd_install/bin") -prepend_path("LD_LIBRARY_PATH", "/hpc/mp/apps/deepmd-kit/2026-03-20/deepmd_install/lib") -prepend_path("C_INCLUDE_PATH", "/hpc/mp/apps/deepmd-kit/2026-03-20/deepmd_install/include") -prepend_path("C_PLUS_INCLUDE_PATH", "/hpc/mp/apps/deepmd-kit/2026-03-20/deepmd_install/include") - execute{cmd="conda activate /hpc/mp/apps/deepmd-kit/2026-03-20/deepmd_env", modeA={"load"}} help([[Name: DeePMD-kit