Standard software environments/fr: Difference between revisions

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= What are standard software environments ? =
= What are standard software environments? =
Compute Canada's software environment is provided through a set of [[Utiliser_des_modules/en|modules]] which allow you to switch between different versions of software packages you may want to use. These modules are organized in a tree, with the main branches being determined by a set of tools such as compilers, MPI distributions and CUDA. At the root of this tree are modules which we call "standard environments", named <code>StdEnv</code>. As of 2020, there are three such standard environments, versioned <code>2016.4</code>, <code>2018.3</code>, and <code>2020</code>. Some major improvements happened between each of these versions. This page is describing these changes, and why you should upgrade to more recent versions. In general, new versions of software packages will get installed with the newest version of our software environment.  
Our software environments are provided through a set of [[Utiliser_des_modules/en|modules]] which allow you to switch between different versions of software packages. These modules are organized in a tree structure with the trunk made up of typical utilities provided by any Linux environment. Branches are compiler versions and sub-branches are versions of MPI or CUDA.  
 
Standard environments identify combinations of specific compiler and MPI modules that are used most commonly by our team to build other software. These combinations are grouped in modules named <code>StdEnv</code>.
 
As of October 2020, there are three such standard environments, versioned 2016.4, 2018.3, and 2020, with each new version incorporating major improvements.
 
This page describes these changes and explains why you should upgrade to a more recent version.  
In general, new versions of software packages will get installed with the newest software environment.


== <code>StdEnv/2016.4</code> ==
== <code>StdEnv/2016.4</code> ==
This was the initial version of our software environment, and was released in 2016, with the deployment of [[Cedar]] and [[Graham]]. This branch features the compilers GCC 5.4.0 and Intel 2016.4 as default compilers, and Open MPI 2.1.1 as its default implementation of MPI. Most of the software compiled with this environment does not support AVX512 instructions provided by the Skylake processors on [[Béluga]], [[Niagara]], as well as the most recent additions to Cedar and Graham.
This is the initial version of our software environment released in 2016 with the deployment of [[Cedar]] and [[Graham]]. It features GCC 5.4.0 and Intel 2016.4 as default compilers, and Open MPI 2.1.1 as its default implementation of MPI. Most of the software compiled with this environment does not support AVX512 instructions provided by the Skylake processors on [[Béluga/en|Béluga]], [[Niagara]], as well as on the most recent additions to Cedar and Graham.


Activez cet environnement avec la commande  
Activez cet environnement avec la commande  
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== <code>StdEnv/2018.3</code> ==
== <code>StdEnv/2018.3</code> ==
This was the second revision of our software environment, and was released in 2018, with the deployment of [[Béluga]], and shortly after the deployment of [[Niagara]]. Defaults were upgraded to GCC 7.3.0, Intel 2018.3, and Open MPI 3.1.2. This was also the first version to really support AVX512 instructions.
This is the second version of our software environment. It was released in 2018 with the deployment of [[Béluga]], and shortly after the deployment of [[Niagara]]. Defaults were upgraded to GCC 7.3.0, Intel 2018.3, and Open MPI 3.1.2. This is the first version to support AVX512 instructions.


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== <code>StdEnv/2020</code> ==
== <code>StdEnv/2020</code> ==
This is the most recent iteration of our software environment, and the largest change so far. It uses GCC 9.3.0, Intel 2020.1, and Open MPI 4.0.3 as defaults. Several changes were made with this release, most of which result in performance improvements.  
This is the most recent iteration of our software environment with the most changes so far. It uses GCC 9.3.0, Intel 2020.1, and Open MPI 4.0.3 as defaults.  


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Activez cet environnement avec la commande  
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=== Performance improvements ===
=== Performance improvements ===
Binaries compiled with the Intel compiler now automatically support both AVX2 and AVX512 instruction sets. In technical terms, we say that they are multi-architecture binaries, also known as [https://en.wikipedia.org/wiki/Fat_binary fat binaries]. This means that when running on a cluster which has multiple generations of processors, such as Cedar and Graham, you don't have to manually load one of the <tt>arch</tt> modules if you use software packages compiled with the Intel compiler.  
Binaries compiled with the Intel compiler now automatically support both AVX2 and AVX512 instruction sets. In technical terms, we call them ''multi-architecture binaries'', also known as [https://en.wikipedia.org/wiki/Fat_binary fat binaries]. This means that when running on a cluster such as Cedar and Graham which has multiple generations of processors, you don't have to manually load one of the <tt>arch</tt> modules if you use software packages generated by the Intel compiler.  


Many software packages which were previously installed either with GCC or with Intel are now installed at a lower level of the software hierarchy, which makes the same module visible irrespective of which compiler is loaded. For example, this is the case for the [[R]] modules, which previously required loading the <code>gcc</code> module. This is also the case for many bioinformatics software packages. This could be done because we introduced optimizations specific to CPU architectures at a level of the software hierarchy lower than the compiler level.  
Many software packages which were previously installed either with GCC or with Intel are now installed at a lower level of the software hierarchy, which makes the same module visible, irrespective of which compiler is loaded. For example, this is the case for many bioinformatics software packages as well as the [[R]] modules, which previously required loading the <code>gcc</code> module. This could be done because we introduced optimizations specific to CPU architectures at a level of the software hierarchy lower than the compiler level.  


We also installed a more recent version of the [https://en.wikipedia.org/wiki/GNU_C_Library GNU C Library], which introduces optimizations in some mathematical functions. This has increased the requirement on the version of the Linux Kernel (see below).  
We also installed a more recent version of the [https://en.wikipedia.org/wiki/GNU_C_Library GNU C Library], which introduces optimizations in some mathematical functions. This has increased the requirement on the version of the Linux Kernel (see below).  


=== Change in the compatibility layer ===
=== Change in the compatibility layer ===
Another major change introduced in the <code>2020</code> release is a switch between two tools for our ''compatibility layer''. This is a layer of the software hierarchy which we provide to isolate it from the underlying operating system. For example, this ensures that our software packages will work whether it is run on CentOS, Ubuntu, or Fedora systems. For the <code>2016.4</code> and <code>2018.3</code> versions, we used the [https://en.wikipedia.org/wiki/Nix_package_manager Nix package manager], while for the <code>2020</code> version, we use [https://wiki.gentoo.org/wiki/Project:Prefix Gentoo Prefix].  
Another enhancement for the 2020 release was a change in tools for our compatibility layer. The compatibility layer is between the operating system and all other software packages. This layer is designed to ensure that compilers and scientific applications will work whether they run on CentOS, Ubuntu, or Fedora. For the 2016.4 and 2018.3 versions, we used the [https://en.wikipedia.org/wiki/Nix_package_manager Nix package manager], while for the 2020 version, we used [https://wiki.gentoo.org/wiki/Project:Prefix Gentoo Prefix].  


=== Change in kernel requirement ===
=== Change in kernel requirement ===
Versions <code>2016.4</code> and <code>2018.3</code> required a Linux kernel version 2.6.32 or more recent. This supported CentOS versions starting at CentOS 6. With the <code>2020</code> version, we require a Linux kernel 3.10 or better. This means it no longer supports CentOS 6, but requires CentOS 7 instead. Other distributions usually have kernels which are much more recent, so you probably do not need to change your distribution if you are using this standard environment on something other than CentOS.
Versions 2016.4 and 2018.3 required a Linux kernel version 2.6.32 or more recent. This supported CentOS versions starting at CentOS 6. With the 2020 version, we require a Linux kernel 3.10 or better. This means it no longer supports CentOS 6, but requires CentOS 7 instead. Other distributions usually have kernels which are much more recent, so you probably don't need to change your distribution if you are using this standard environment on something other than CentOS.


= How can I change which version of <code>StdEnv</code> is my default? =
= How can I change which version of <code>StdEnv</code> is my default? =
Our clusters use different versions of <code>StdEnv</code> as their default version. As of August 2020, [[Cedar]] and [[Graham]] use <code>StdEnv/2016.4</code>, while [[Béluga]] uses <code>StdEnv/2018.3</code>.  [[Niagara]] also defaults to <code>StdEnv/2018.3</code> if you <code>module load CCEnv StdEnv</code>. In the future, we will probably switch all of them to use <code>StdEnv/2020</code>, but that time hasn't come yet. Users can however specify their own default by running the following command (example provided for the <code>2020</code> version):
Our clusters use different versions of <code>StdEnv</code> as their default version. As of August 2020, [[Cedar]] and [[Graham]] use <code>StdEnv/2016.4</code>, while [[Béluga/en|Béluga]] uses <code>StdEnv/2018.3</code>.  [[Niagara]] also defaults to <code>StdEnv/2018.3</code> if you <code>module load CCEnv StdEnv</code>. In the future, we will probably switch all of them to use <code>StdEnv/2020</code>. Users can however specify their own default by running the following command (example provided for the 2020 version)  
{{Command|echo "module-version StdEnv/2020 default" >> $HOME/.modulerc}}
{{Command|echo "module-version StdEnv/2020 default" >> $HOME/.modulerc}}


= Do I need to reinstall/recompile my code if the <code>StdEnv</code> version changes? =
= Do I need to reinstall/recompile my code if the <code>StdEnv</code> version changes? =
If you compile your own code, or install R or Python packages, yes, you should recompile or reinstall the packages you need using the newer version of the standard environment.
Yes. If you compile your own code, or install R or Python packages, you should recompile or reinstall the packages you need using the newer version of the standard environment.
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