Differences

This shows you the differences between two versions of the page.

--- cluster:73 [2021/11/04 19:38]
hmeij07 [EasyBuild]
+++ cluster:73 [2021/11/22 17:15]
hmeij07 [Hoomd]
@@ Line 38: / Line 38: @@
     * https://dokuwiki.wesleyan.edu/doku.php?id=cluster:209#emcee
     * contains package mpi4py, multithreading
+  * PyCUDA/2020.1-fosscuda-2020b
+    *
 To use module, discover the modules and load desired module. On ''greentail52'' (debugging) or in submit scripts on queue: exx96 (mwgpu and amber128 nodes do not work)
@@ Line 44: / Line 46: @@
 # cuda libs location
-export LD_LIBRARY_PATH=/sanscratch/CENTOS7/easybuild/4.4.2/software/CUDAcore/11.1.1/stubs/lib64:$LD_LIBRARY_PATH
+export LD_LIBRARY_PATH=\
+/sanscratch/CENTOS7/easybuild/4.4.2/software/CUDAcore/11.1.1/lib64:\
+/sanscratch/CENTOS7/easybuild/4.4.2/software/CUDAcore/11.1.1/lib:\
+/sanscratch/CENTOS7/easybuild/4.4.2/software/CUDAcore/11.1.1/targets/x86_64-linux/lib/stubs:\
+$LD_LIBRARY_PATH
 # discover all modules
@@ Line 119: / Line 126: @@
 </code>
+  * and
+<code>
+conda install -c conda-forge gsd
+The following NEW packages will be INSTALLED:
+  _openmp_mutex      conda-forge/linux-64::_openmp_mutex-4.5-1_gnu
+  gsd                conda-forge/linux-64::gsd-2.5.1-py38h6c62de6_0
+  libgomp            conda-forge/linux-64::libgomp-11.2.0-h1d223b6_11
+The following packages will be UPDATED:
+  certifi                          2021.10.8-py38h578d9bd_0 --> 2021.10.8-py38h578d9bd_1
+  conda                               4.10.3-py38h578d9bd_2 --> 4.10.3-py38h578d9bd_4
+  libgcc-ng           pkgs/main::libgcc-ng-9.1.0-hdf63c60_0 --> conda-forge::libgcc-ng-11.2.0-h1d223b6_11
+  openssl                                 1.1.1h-h516909a_0 --> 1.1.1l-h7f98852_0
+</code>
 ====== Miniconda2 ======

DokuWiki

User Tools

Site Tools

Differences

Page Tools