From 025a96fe5a6752dac9603a5e72ec8fc1d15fbe86 Mon Sep 17 00:00:00 2001 From: Mats Rynge Date: Wed, 14 Sep 2022 18:20:47 -0500 Subject: [PATCH] Updated container list --- start/software/available-containers-list.md | 28 +++++++++---------- update/container-list/container-list.template | 4 +-- 2 files changed, 15 insertions(+), 17 deletions(-) diff --git a/start/software/available-containers-list.md b/start/software/available-containers-list.md index 92e22924..b275db4e 100644 --- a/start/software/available-containers-list.md +++ b/start/software/available-containers-list.md @@ -1,11 +1,10 @@ -[title]: - "View Existing OSPool-Supported Containers" +[title]: - "Available Containers List" [TOC] This is list of commonly used containers in the Open Science Pool. These can be used directly in your jobs or as base images if you want to define your own. Please -see the pages on [container overview][container-intro] and [creating containers][container-howto] -for detailed instructions on how to use containers and/or have Docker containers added to the OSPool's approved list. +see the pages on [container overview][container-intro] for detailed instructions. Also note that this list is not complete. There are many images under `/cvmfs/singularity.opensciencegrid.org/` which are either project specific @@ -18,7 +17,7 @@ or not described well enough to make this list. |:---------|:--------------------|:----------------| | EL 6 | /cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-el6:latest | Enterprise Linux (CentOS) 6 base image
[Project Website](https://www.centos.org/)
[Container Definition](https://github.com/opensciencegrid/osgvo-el6) | | EL 7 | /cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-el7:latest | Enterprise Linux (CentOS) 7 base image
[Project Website](https://www.centos.org/)
[Container Definition](https://github.com/opensciencegrid/osgvo-el7) | -| EL 8 | /cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-el8:latest | Enterprise Linux (CentOS) 8 base image
[Project Website](https://www.centos.org/)
[Container Definition](https://github.com/opensciencegrid/osgvo-el8) | +| EL 8 | /cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-el8:latest | Enterprise Linux (Rocky) 8 base image
[Project Website](https://www.rockylinux.org/)
[Container Definition](https://github.com/opensciencegrid/osgvo-el8) | | Ubuntu 16.04 | /cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-ubuntu-xenial:latest | Ubuntu 16.04 (Xenial) base image
[Project Website](https://www.ubuntu.com)
[Container Definition](https://github.com/opensciencegrid/osgvo-ubuntu-xenial) | | Ubuntu 18.04 | /cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-ubuntu-18.04:latest | Ubuntu 18.04 (Bionic) base image
[Project Website](https://www.ubuntu.com)
[Container Definition](https://github.com/opensciencegrid/osgvo-ubuntu-18.04) | | Ubuntu 20.04 | /cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-ubuntu-20.04:latest | Ubuntu 20.04 (Focal) base image
[Project Website](https://www.ubuntu.com)
[Container Definition](https://github.com/opensciencegrid/osgvo-ubuntu-20.04) | @@ -27,31 +26,32 @@ or not described well enough to make this list. | **Name** | **CVMFS Locations** | **Description** | |:---------|:--------------------|:----------------| -| Julia | /cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-julia:latest | Ubuntu based image with Julia
[Project Website](https://julialang.org/)
[Container Definition](https://github.com/opensciencegrid/osgvo-julia) | +| Julia | /cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-julia:1.0.3
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-julia:1.5.3
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-julia:1.7.3
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-julia:latest | Ubuntu based image with Julia
[Project Website](https://julialang.org/)
[Container Definition](https://github.com/opensciencegrid/osgvo-julia) | | Matlab Runtime | /cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-matlab-runtime:R2018b
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-matlab-runtime:R2019a
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-matlab-runtime:R2019b
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-matlab-runtime:R2020a
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-matlab-runtime:R2020b | This is the Matlab runtime component you can use to execute compiled Matlab codes
[Project Website](https://www.mathworks.com/products/compiler/matlab-runtime.html)
[Container Definition](https://github.com/opensciencegrid/osgvo-matlab-runtime) | -| R | /cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-r:3.5.0
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-r:4.0.2 | Example for building R images
[Project Website](https://www.r-project.org/)
[Container Definition](https://github.com/opensciencegrid/osgvo-r) | +| R | /cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-r:3.5.0
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-r:4.0.2
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-r:latest | Example for building R images
[Project Website](https://www.r-project.org/)
[Container Definition](https://github.com/opensciencegrid/osgvo-r) | +| R | /cvmfs/singularity.opensciencegrid.org/clkwisconsin/spacetimer:latest | Example for building R images
[Project Website](https://www.r-project.org/)
[Container Definition](https://github.com/opensciencegrid/osgvo-r) | ## Project | **Name** | **CVMFS Locations** | **Description** | |:---------|:--------------------|:----------------| -| XENONnT | /cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2020.11.06
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2020.11.25
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:development
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:latest
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:py38 | Base software environment for XENONnT, including Python 3.6 and data management tools
[Project Website](http://www.xenon1t.org/)
[Container Definition](https://github.com/XENONnT/base_environment) | -| XENONnT | /cvmfs/singularity.opensciencegrid.org/xenonnt/osg_dev:latest | Base software environment for XENONnT, including Python 3.6 and data management tools
[Project Website](http://www.xenon1t.org/)
[Container Definition](https://github.com/XENONnT/base_environment) | -| XENONnT | /cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2020.11.06
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2020.11.25
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:development
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:latest
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:py38 | Base software environment for XENONnT, including Python 3.6 and data management tools
[Project Website](http://www.xenon1t.org/)
[Container Definition](https://github.com/XENONnT/base_environment) | -| XENONnT | /cvmfs/singularity.opensciencegrid.org/xenonnt/montecarlo:development
/cvmfs/singularity.opensciencegrid.org/xenonnt/montecarlo:latest | Base software environment for XENONnT, including Python 3.6 and data management tools
[Project Website](http://www.xenon1t.org/)
[Container Definition](https://github.com/XENONnT/base_environment) | +| XENONnT | /cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2020.11.06
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2020.11.25
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2020.12.21
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2020.12.23
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2021.01.04
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2021.01.06
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2021.01.11
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2021.04.18
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2021.05.04
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2021.06.25
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2021.07.1
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2021.08.1
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2021.08.2
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2021.10.1
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2021.10.2
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2021.10.3
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2021.10.4
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2021.10.5
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2021.11.1
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2021.11.2
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2021.11.3
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2021.11.4
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2021.11.5
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2021.11.6
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2021.12.1
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2021.12.2
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2021.12.3
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2022.01.2
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2022.01.3
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2022.01.4
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2022.02.1
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2022.02.2
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2022.02.3
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2022.02.4
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2022.03.1
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2022.03.3
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2022.03.4
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2022.03.5
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2022.04.1
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2022.04.2
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2022.04.3
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2022.05.1
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2022.05.2
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2022.06.1
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2022.06.2
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2022.06.3
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2022.07.27
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:2022.09.1
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:add_latex
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:development
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:gpu
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:latest
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:latex_test3
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:py38
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:stable
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:straxen_0-13-1
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:straxen_v100
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-xenon:upgrade-boost | Base software environment for XENONnT, including Python 3.6 and data management tools
[Project Website](http://www.xenon1t.org/)
[Container Definition](https://github.com/XENONnT/base_environment) | +| XENONnT | /cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2020.11.06
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2020.11.25
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2020.12.21
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2020.12.23
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2020.12.24
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2021.01.04
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2021.01.06
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2021.01.11
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2021.04.18
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2021.05.04
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2021.06.25
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2021.07.1
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2021.08.1
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2021.08.2
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2021.10.1
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2021.10.2
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2021.10.3
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2021.10.4
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2021.10.5
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2021.11.1
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2021.11.2
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2021.11.3
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2021.11.4
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2021.11.5
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2021.11.6
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2021.12.1
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2021.12.2
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2021.12.3
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2022.01.2
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2022.01.3
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2022.01.4
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2022.02.1
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2022.02.2
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2022.02.3
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2022.02.4
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2022.03.1
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2022.03.3
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2022.03.4
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2022.03.5
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2022.04.1
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2022.04.2
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2022.04.3
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2022.05.1
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2022.05.2
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2022.06.1
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2022.06.2
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2022.06.3
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2022.07.27
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:2022.09.1
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:add_latex
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:development
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:gpu
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:latest
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:latex_test3
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:py38
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:stable
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:straxen_v100
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:testing
/cvmfs/singularity.opensciencegrid.org/xenonnt/base-environment:upgrade-boost | Base software environment for XENONnT, including Python 3.6 and data management tools
[Project Website](http://www.xenon1t.org/)
[Container Definition](https://github.com/XENONnT/base_environment) | +| XENONnT | /cvmfs/singularity.opensciencegrid.org/xenonnt/montecarlo:2021.01.12
/cvmfs/singularity.opensciencegrid.org/xenonnt/montecarlo:2021.08.1
/cvmfs/singularity.opensciencegrid.org/xenonnt/montecarlo:2021.08.2
/cvmfs/singularity.opensciencegrid.org/xenonnt/montecarlo:2021.11.1
/cvmfs/singularity.opensciencegrid.org/xenonnt/montecarlo:2022.01.4
/cvmfs/singularity.opensciencegrid.org/xenonnt/montecarlo:2022.06.1
/cvmfs/singularity.opensciencegrid.org/xenonnt/montecarlo:2022.06.3-wfsim1.0.1
/cvmfs/singularity.opensciencegrid.org/xenonnt/montecarlo:development
/cvmfs/singularity.opensciencegrid.org/xenonnt/montecarlo:latest
/cvmfs/singularity.opensciencegrid.org/xenonnt/montecarlo:py38 | Base software environment for XENONnT, including Python 3.6 and data management tools
[Project Website](http://www.xenon1t.org/)
[Container Definition](https://github.com/XENONnT/base_environment) | ## Tools | **Name** | **CVMFS Locations** | **Description** | |:---------|:--------------------|:----------------| -| FreeSurfer | /cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-freesurfer:6.0.0
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-freesurfer:6.0.1
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-freesurfer:7.0.0 | A software package for the analysis and visualization of structural and functional neuroimaging data from cross-sectional or longitudinal studies
[Project Website](https://surfer.nmr.mgh.harvard.edu/fswiki/FreeSurferWiki)
[Container Definition](https://github.com/opensciencegrid/osgvo-freesurfer) | -| GROMACS | /cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-gromacs:latest | A versatile package to perform molecular dynamics, i.e. simulate the Newtonian equations of motion for systems with hundreds to millions of particles.
[Project Website](http://www.gromacs.org/)
[Container Definition](https://github.com/opensciencegrid/osgvo-gromacs) | +| FreeSurfer | /cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-freesurfer:6.0.0
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-freesurfer:6.0.1
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-freesurfer:7.0.0
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-freesurfer:7.1.1
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-freesurfer:latest | A software package for the analysis and visualization of structural and functional neuroimaging data from cross-sectional or longitudinal studies
[Project Website](https://surfer.nmr.mgh.harvard.edu/fswiki/FreeSurferWiki)
[Container Definition](https://github.com/opensciencegrid/osgvo-freesurfer) | +| GROMACS | /cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-gromacs:2018.4
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-gromacs:2020.2
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-gromacs:latest | A versatile package to perform molecular dynamics, i.e. simulate the Newtonian equations of motion for systems with hundreds to millions of particles.
[Project Website](http://www.gromacs.org/)
[Container Definition](https://github.com/opensciencegrid/osgvo-gromacs) | | GROMACS GPU | /cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-gromacs-gpu:latest | A versatile package to perform molecular dynamics, i.e. simulate the Newtonian equations of motion for systems with hundreds to millions of particles. This is a GPU enabled version.
[Project Website](http://www.gromacs.org/)
[Container Definition](https://github.com/opensciencegrid/osgvo-gromacs-gpu) | -| Quantum Espresso | /cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-quantum-espresso:6.6 | A suite for first-principles electronic-structure calculations and materials modeling
[Project Website](https://www.quantum-espresso.org/)
[Container Definition](https://github.com/opensciencegrid/osgvo-quantum-espresso) | +| Psi4 | /cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-psi4:latest | Psi4 is an open-source suite of ab initio quantum chemistry programs designed for efficient, high-accuracy simulations of molecular properties.
[Project Website](https://psicode.org/)
[Container Definition](https://github.com/opensciencegrid/osgvo-psi4) | +| Quantum Espresso | /cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-quantum-espresso:6.6
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-quantum-espresso:6.8 | A suite for first-principles electronic-structure calculations and materials modeling
[Project Website](https://www.quantum-espresso.org/)
[Container Definition](https://github.com/opensciencegrid/osgvo-quantum-espresso) | +| RASPA | /cvmfs/singularity.opensciencegrid.org/opensciencegrid/osgvo-raspa2:2.0.41 | General purpose classical simulation package. It can be used for the simulation of molecules in gases, fluids, zeolites, aluminosilicates, metal-organic frameworks, carbon nanotubes and external fields.
[Project Website](https://github.com/iraspa/RASPA2)
[Container Definition](https://github.com/opensciencegrid/osgvo-raspa2) | | TensorFlow | /cvmfs/singularity.opensciencegrid.org/opensciencegrid/tensorflow:2.3
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/tensorflow:latest | TensorFlow image (CPU only)
[Project Website](https://www.tensorflow.org/)
[Container Definition](https://github.com/opensciencegrid/osgvo-tensorflow) | | TensorFlow GPU | /cvmfs/singularity.opensciencegrid.org/opensciencegrid/tensorflow-gpu:2.2-cuda-10.1
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/tensorflow-gpu:2.3-cuda-10.1
/cvmfs/singularity.opensciencegrid.org/opensciencegrid/tensorflow-gpu:latest | TensorFlow image with GPU support
[Project Website](https://www.tensorflow.org/)
[Container Definition](https://github.com/opensciencegrid/osgvo-tensorflow-gpu) | [container-intro]: 12000024676 -[container-howto]: 12000058245 diff --git a/update/container-list/container-list.template b/update/container-list/container-list.template index 11734f43..4d67dd9e 100644 --- a/update/container-list/container-list.template +++ b/update/container-list/container-list.template @@ -4,8 +4,7 @@ This is list of commonly used containers in the Open Science Pool. These can be used directly in your jobs or as base images if you want to define your own. Please -see the pages on [container overview][container-intro] and [defining containers][container-howto] -for detailed instructions. +see the pages on [container overview][container-intro] for detailed instructions. Also note that this list is not complete. There are many images under `/cvmfs/singularity.opensciencegrid.org/` which are either project specific @@ -14,5 +13,4 @@ or not described well enough to make this list. $table [container-intro]: 12000024676 -[container-howto]: 12000058245