Jul
18
Wed
Open Source Software
Jul 18 @ 1:00 pm – 2:00 pm

The IDEAS Productivity project, in partnership with the DOE Computing Facilities of the ALCF, OLCF, and NERSC and the DOE Exascale Computing Project (ECP) facilitates a webinar series on Best Practices for HPC Software Developers.

As part of this series, we offer one-hour webinars on topics in scientific software development and high-performance computing, approximately once a month. The next webinar in the series was titled “How Open Source Software Supports the Largest Computers on the Planet”, and was presented by Ian Lee of Lawrence Livermore National Laboratory.  The webinar took place on Wednesday, July 18, 2018 at 1:00 pm ET.

Abstract:

This talk provided an overview of the work at Lawrence Livermore National Laboratory to re-vamp their open source project offerings, release processes, and engagements across the Department of Energy and the US Government through efforts such as DOECode and Code.gov. The presenter discussed ongoing work to make it easier for Livermore staff to engage with open source communities, via both the creation of new projects and contributions to existing open source projects.  These experiences and insights may be useful to a wide range of developers of high-performance scientific software.

Aug
21
Tue
Software Sustainability – Lessons Learned
Aug 21 @ 12:00 pm – 1:00 pm

The IDEAS Productivity project, in partnership with the DOE Computing Facilities of the ALCF, OLCF, and NERSC and the DOE Exascale Computing Project (ECP) has resumed the webinar series on Best Practices for HPC Software Developers, which we began in 2016.

As part of this series, we offer one-hour webinars on topics in scientific software development and high-performance computing, approximately once a month. The next webinar in the series is titled “Software Sustainability – lessons learned from different disciplines”, and will be presented by Neil Chue Hong of the Software Sustainability Institute (University of Edinburgh).  The webinar will take place on Wednesday, August 21, 2018 at 12:00 pm ET.

Abstract:

How do you make software sustainable? How much is it about process and how much about practice? Does it vary between countries or disciplines? In this webinar, I’ll present what the UK’s Software Sustainability Institute has learned from 8 years of work in this area including efforts around understanding the scale of software use in research, raising the profile of software as a key part of the research ecosystem, and how we can enable researchers and developers to build better software.

Sep
19
Wed
Modern CMake
Sep 19 @ 1:00 pm – 2:00 pm

The IDEAS Productivity project, in partnership with the DOE Computing Facilities of the ALCF, OLCF, and NERSC and the DOE Exascale Computing Project (ECP) has resumed the webinar series on Best Practices for HPC Software Developers, which we began in 2016.

As part of this series, we offer one-hour webinars on topics in scientific software development and high-performance computing, approximately once a month. The next webinar in the series was titled Modern CMake, and was presented by Bill Hoffman.  The webinar took place on Wednesday, September 19, 2018 at 1:00 pm ET.

Abstract:

Bill Hoffman, the creator of the CMake project, will give an introduction to development with modern CMake constructs. CMake is 17 years old and has evolved over time into the most widely used C++ build  tool in the world. In the past 5 years, many new features have been added to CMake to make the creation of cross-platform build files easier. This webinar will provide best practices for development and maintenance of a CMake build system.  The webinar will cover the “target centric” approach to writing CMake files. In addition, testing and quality dashboards with CDash will be covered. Kitware’s experience with HPC systems and CMake will also be discussed.

Oct
17
Wed
Open Source Best Practices: From Continuous Integration to Static Linters
Oct 17 @ 1:00 pm – 2:00 pm

The IDEAS Productivity project, in partnership with the DOE Computing Facilities of the ALCF, OLCF, and NERSC and the DOE Exascale Computing Project (ECP) has resumed the webinar series on Best Practices for HPC Software Developers, which we began in 2016.

As part of this series, we offer one-hour webinars on topics in scientific software development and high-performance computing, approximately once a month. The next webinar is titled Open Source Best Practices: From Continuous Integration to Static Linters, and will be presented by Daniel Smith and Ben Pritchard (members of the NSF-funded Molecular Sciences Software Institute, or MolSSI). The webinar will take place on Wednesday, October 17, 2018 at 1:00 pm ET.

Abstract:

This webinar will continue the discussion of open source software (OSS) opportunities within the scientific ecosystem to include the many cloud and local services available to OSS free of charge. The services to be discussed include continuous integration, code coverage, and static analysis. The presenters will demonstrate the usefulness of these tools and how a small time investment at the beginning is traded for long-term benefits. These services and ideas are agnostic to software language or HPC software application and should apply to any party interested in tools that help ease the burden of software maintenance.

Dec
5
Wed
Introduction to Software Licensing
Dec 5 @ 1:00 pm – 2:00 pm

The IDEAS Productivity project, in partnership with the DOE Computing Facilities of the ALCF, OLCF, and NERSC and the DOE Exascale Computing Project (ECP) has resumed the webinar series on Best Practices for HPC Software Developers, which we began in 2016.

As part of this series, we offer one-hour webinars on topics in scientific software development and high-performance computing, approximately once a month. The next webinar is titled Introduction to Software Licensing, and will be presented by David Bernholdt (Oak Ridge National Laboratory). The webinar took place on Wednesday, December 5, 2018 at 1:00 pm ET.

Abstract:

Software licensing and related matters of intellectual property can often seem confusing or hopelessly complicated, especially when many present their opinions as dogma. This presentation takes a different approach: getting you to think about software licensing from the standpoint of what you want others to be able to do (or not do) with your software. We started by developing a common understanding of the terminology used around software licenses. Then considered various scenarios of what you might want to accomplish with a software license, and what to look for in the license. We also discussed some pragmatic issues around actually applying a license to your software.

Jan
23
Wed
Quantitatively Assessing Performance Portability with Roofline
Jan 23 @ 1:00 pm – 2:00 pm

The IDEAS Productivity project, in partnership with the DOE Computing Facilities of the ALCF, OLCF, and NERSC and the DOE Exascale Computing Project (ECP) has resumed the webinar series on Best Practices for HPC Software Developers, which we began in 2016.

As part of this series, we offer one-hour webinars on topics in scientific software development and high-performance computing, approximately once a month. The next webinar is titled Quantitatively Assessing Performance Portability with Roofline, and will be presented by John Pennycook (Intel), Charlene Yang (Lawrence Berkeley National Laboratory) and Jack Deslippe (Lawrence Berkeley National Laboratory). The webinar will take place on Wednesday, January 23, 2019 at 1:00 pm ET.

Abstract:

Wouldn’t it be great if we could port a code to a new high-performance architecture without substantially changing the code yet achieving a similar level of performance as hand-optimized code? This webinar will frame the discussion around ‘performance portability’, why it is important and desirable, and how to quantitatively measure it. The webinar started with a background check on how the concept of performance portability came about and past attempts to define it and quantify it. Then the speaker introduced a simple yet powerful metric and an empirical methodology to quantitatively assess a code’s performance portability across multiple platforms. The methodology uses the Roofline performance model to measure an ‘architectural efficiency’ term in the metric proposed by Pennycook et al. The speaker then dove into a few nuances of this methodology, for example, how and why empirical ceilings should be used for performance bounds, how to accurately account for complex instructions such as divides, how to model strided memory accesses, and how to select the appropriate Roofline ceilings and application performance points to make sure that the performance portability analysis is not erroneously skewed. We also showed some results of measuring performance portability using the aforementioned metric and methodology on two modern architectures, Intel Xeon Phi and NVIDIA V100 GPUs.

Feb
13
Wed
Containers in HPC
Feb 13 @ 1:00 pm – 2:00 pm

The IDEAS Productivity project, in partnership with the DOE Computing Facilities of the ALCF, OLCF, and NERSC and the DOE Exascale Computing Project (ECP) has resumed the webinar series on Best Practices for HPC Software Developers, which we began in 2016.

As part of this series, we offer one-hour webinars on topics in scientific software development and high-performance computing, approximately once a month. The next webinar is titled Containers in HPC, and will be presented by Shane Canon (LBNL). The webinar will take place on Wednesday, February 13, 2019 at 1:00 pm ET

Abstract:

Containers have gained adoption in the HPC and scientific computing space through specialized runtimes like Shifter, Singularity and Charliecloud. Containers enable reproducible, shareable, portable execution of applications. In this webinar, we will give a brief introduction on how to build images and run containers on HPC systems. We will also discuss some best practices to ensure containers can take full advantage of HPC systems.

Mar
13
Wed
Parallel I/O with HDF5: Overview, Tuning, and New Features
Mar 13 @ 1:00 pm – 2:00 pm

The IDEAS Productivity project, in partnership with the DOE Computing Facilities of the ALCF, OLCF, and NERSC and the DOE Exascale Computing Project (ECP) has resumed the webinar series on Best Practices for HPC Software Developers, which we began in 2016.

As part of this series, we offer one-hour webinars on topics in scientific software development and high-performance computing, approximately once a month. The next webinar was titled Parallel I/O with HDF5: Overview, Tuning, and New Features, and was presented by Quincey Koziol (NERSC). The webinar took place on Wednesday, March 13, 2019 at 1:00 pm ET

Abstract:

HDF5 is a data model, file format, and I/O library that has become a de facto standard for HPC applications to achieve scalable I/O and for storing and managing big data from computer modeling, large physics experiments and observations. This webinar gave an introduction to using the HDF5 library, with a focus on parallel I/O and performance tuning options. The webinar also presented an overview of the latest performance and productivity enhancement features being developed as part of the DOE’s Exascale Computing Project (ECP) ExaHDF5 effort, and optimizations used in improving I/O performance of ECP applications.

Apr
10
Wed
Testing Fortran Software with pFUnit
Apr 10 @ 1:00 pm – 2:00 pm

The IDEAS Productivity project, in partnership with the DOE Computing Facilities of the ALCF, OLCF, and NERSC and the DOE Exascale Computing Project (ECP) has resumed the webinar series on Best Practices for HPC Software Developers, which we began in 2016.

As part of this series, we offer one-hour webinars on topics in scientific software development and high-performance computing, approximately once a month. The next webinar is titled Testing Fortran Software with pFUnit, and will be presented by Thomas Clune (NASA). The webinar will take place on Wednesday, April 10, 2019 at 1:00 pm ET

Abstract:

Over the past two decades, the emergence of highly effective software testing frameworks has greatly simplified the development and use of unit tests and has led to new software development paradigms such as test driven development (TDD).  However, technical computing introduces a number of unique testing challenges, including distributed parallelism and numerical accuracy.  This webinar will begin with a basic introduction to the use of pFUnit to develop tests for MPI+Fortran software and then present some of the new capabilities in the latest release.  We will also discuss some specialized methodologies for testing numerical algorithms and speculate about future framework capabilities that may improve our ability to test at exascale.

May
8
Wed
So, You Want to be Agile? Strategies for Introducing Agility into Your Scientific Software Project
May 8 @ 1:00 pm – 2:00 pm

The IDEAS Productivity project, in partnership with the DOE Computing Facilities of the ALCF, OLCF, and NERSC and the DOE Exascale Computing Project (ECP) has resumed the webinar series on Best Practices for HPC Software Developers, which we began in 2016.

As part of this series, we offer one-hour webinars on topics in scientific software development and high-performance computing, approximately once a month. The next webinar is titled So, You Want to be Agile? Strategies for Introducing Agility into Your Scientific Software Project, and will be presented by Michael Heroux (Sandia National Laboratories). The webinar will take place on Wednesday, May 8, 2019 at 1:00 pm ET.

Abstract:

Scientific software team cultures have natural consistencies with agile practices. Discovery-driven development, a focus on regular delivery of results, in-person discussions within and across research teams, and a focus on long-term sustainable research programs are commonplace dynamics on computational science teams that develop software. These dynamics are also particular expressions of core agile principles.

Many scientific software teams have already assimilated industry best practices in some aspects of their work. The advent of open software development platforms such as GitHub and GitLab have accelerated awareness and adoption, as have numerous on-line resources that enable a motivated person to continue learning new ideas and approaches. Even so, we propose that a healthy team habit is continued exploration and improvement of software practices, processes and skills.

In this webinar, we discuss a few agile practices and strategies that are readily adapted and adopted by scientific software teams. In addition, we describe an attitude and strategy for continual process improvement that enables computational science teams to simultaneously deliver science results and, at the same time, dedicate a slice of time to improving software practices on their way to delivering those results.