[gmx-developers] Gromacs and Namd workshop during SC15

Rossen Apostolov rossen at kth.se
Wed Oct 14 22:16:51 CEST 2015


Yes but please check with the organizer Arno Proeme <aproeme at epcc.ed.ac.uk>.

Rossen

On 14/10/15 21:28, Roland Schulz wrote:
> I'll be there. But the abstract deadline is already passed, correct?
>
> On Tue, Oct 6, 2015 at 6:17 AM, Rossen Apostolov <rossen at kth.se 
> <mailto:rossen at kth.se>> wrote:
>
>     Hi everyone,
>
>     MD news for those who will be at SC15 in Austin. This year year there
>     will be also a workshop on molecular simulations with keynotes by Erik
>     Lindahl (GROMACS) and Jim Phillips (NAMD). The discussions on MD
>     development will be very interesting and highly recommended for
>     those of
>     you who could make it to the conference and send an abstract for
>     participation.
>
>     Below is the full announcement with more info.
>
>     Cheers,
>     Rossen
>
>
>     <-- Abstract submission deadline extended to Friday October 9th (13:00
>     CDT / 19:00 BST) -->
>
>     This year's SC15 International Conference for High Performance
>     Computing, Networking,
>     Storage and Analysis features the following Workshop:
>
>     =====================================================================
>          Producing High-Performance and Sustainable Software for Molecular
>     Simulation
>
>                              November 20th, 2015
>                                  Austin, Texas
>     =====================================================================
>
>     This workshop aims to bring together developers and users of molecular
>     simulation
>     software, experts in high-performance computing, and researchers of
>     numerical methods
>     and algorithms to discuss the challenge of creating and maintaining
>     high-performance
>     sustainable software for molecular simulation.
>
>     Invited Speakers
>     ----------------------
>
>     o Prof. Erik Lindahl (GROMACS)
>     KTH Royal Institute of Technology and Stockholm University
>
>     o James Phillips (Senior Research Programmer and NAMD Lead Developer)
>     University of Illinois at Urbana-Champaign)
>
>
>     Call for Abstracts
>     -----------------------
>     Abstracts are sought outlining proposed contributions (2-4 pages)
>     to an
>     open access
>     workshop report / positional paper documenting state of the art
>     developments, current
>     bottlenecks, anticipated challenges, and priorities for future
>     research
>     and funding
>     for molecular simulation software. Three of the accepted abstracts
>     will
>     be selected
>     to give short talks at the workshop. The resulting joint paper will be
>     made available
>     online for free in an institutional repository in citable form with a
>     unique and
>     persistent location identifier.
>
>     The deadline for abstract submission is Friday October 9th (13:00
>     CDT /
>     19:00 BST)
>
>     Authors will be notified Wednesday October 14th to allow SC15 early
>     registration fee
>     to be obtained by registering on or before October 15th.
>
>     Abstracts can be submitted at
>     https://easychair.org/conferences/?conf=sc15molsimsoftware
>
>     We are especially seeking the following kinds of contributions:
>
>     o Hot topics: recent work with (potential for) high impact on
>     performance and / or
>     sustainability of molecular simulation software (e.g. algorithms,
>     forcefield models,
>     parallelisation schemes and use of programming models, software
>     development practices,
>     exploiting new hardware).
>
>     o Case studies: perspectives on achieving performance and / or
>     sustainability based
>     on experience in particular application areas, software development
>     initiatives,
>     etc. (e.g. interplay between optimisation and portability, analysis of
>     goals and
>     challenges, routes and barriers to success - technical, funding).
>
>     Suggested Topics:
>
>     Accelerators and heterogenous computing
>     Algorithms
>     Benchmarking and performance comparisons
>     Computational models
>     Data formats and interoperability of packages
>     Libraries and APIs
>     Numerical methods
>     Parallelisation strategies and load balancing
>     Portability
>     Software development practices and collaborative models
>     Testing
>     Workflows
>
>     More Information
>     -----------------------
>     http://www.apes-soft.org/sc15
>     http://sc15.supercomputing.org/schedule/event_detail?evid=wksp144
>
>     Questions about submissions: sc15molsimsoftware (at) easychair.org
>     <http://easychair.org>
>     Any other questions about the workshop: aproeme (at) epcc (dot)
>     ed.ac.uk <http://ed.ac.uk>
>     =======================
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>
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> ORNL/UT Center for Molecular Biophysics cmb.ornl.gov <http://cmb.ornl.gov>
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