ngc-container-environment-modules

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Relion GUI is not in relion/3.* containers

4

Can not launch the Relion GUI for the 3.* version of the containers: ``` $ module load relion/3.1.0 $ relion INFO legacy OFED driver set: 4.7-3.2.9.0 FATAL Failed to find...

lgorenstein

Make all modules export a variable with their image name

2

Something it's very convenient to do a quick `singularity shell` or `singularity exec` with the container - which requires to know where the image is. Having the module define an...

lgorenstein

Add '--pid' to the singularity command

5

I noticed that sometimes if the application run is interrupted (e.g. Ctrl-C'd), it leaves behind some of this processes (mpiexec.hydra, or python, etc). I discovered it while playing with a...

lgorenstein

Add GAMESS module

2

Please take a look at my attempt to create a module for the [GAMESS container](https://ngc.nvidia.com/catalog/containers/hpc:gamess). Took a bit of sweat because of a very particular input and output locations that...

lgorenstein

Suggested by @laytonjbgmail

samcmill