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Event Calendar

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BioExcel / PRACE Seasonal School 2019, Sweden – HPC for Life Sciences

The main developers of some of the most popular and well-known applications for molecular modelling and simulations (GROMACS, AMBER, NAMD and VMD) are brought together in this event. Molescular modelling and simulations are an integral part of biomolecular research but the usage of HPC resources is still not sufficiently used. The school programm will allow […]

BioExcel Summer School on Biomolecular Simulations 2019

The summer school will include lectures and hands-on sessions on the following topics: Molecular Dynamics simulations Biomolecular Docking QM/MM Free energy calculations Advanced sampling methods (Metadynamics) During the hands-on computer practicals participants will work on a use case integrating the various topics above making use, among others, of the BioExcel flagship software (GROMACS, HADDOCK, PMX).

Partnership for Advanced Computing in Europe (PRACE) Summer of HPC 2019

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Summer of HPC is a PRACE programme that offers summer placements at HPC centres across Europe to late stage undergraduates and/or master students. Up to twenty top applicants from across Europe are selected to participate each year, and applications for the program usually open in January of each year. Participants will spend two months working […]

High Throughput Computing Hackathon

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The workshop will be 3.5 days long consisting of 1.5 days with three different Python libraries related to Dask: Dask: https://docs.dask.org/en/latest/ Dask_jobqueue: https://dask-jobqueue.readthedocs.io/en/latest/ jobqueue_features: https://github.com/E-CAM/jobqueue_features The last library is something that has been developed since last year by E-CAM. It allows the user to create tasks that call out to MPI programs, and easily configure the tasks to […]

PoP webinar: Software for Linear Algebra Targeting Exascales (SLATE) Project

In this 30 minute live webinar, we will discuss the SLATE Project. SLATE is to provide fundamental dense linear algebra capabilities for today’s high-performance computing (HPC) community. To this end, SLATE will provide basic dense matrix operations (e.g., matrix multiplication, rank-k update, triangular solve), linear systems solvers, least square solvers, singular value and eigenvalue solvers. […]

International HPC Summer School

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Graduate students and postdoctoral scholars from institutions in Canada, Europe, Japan and the United States have been invited to apply for the 10th International HPC Summer School, to be held July 7-12, 2019 in Kobe, Japan, hosted by the RIKEN Center for Computational Science (R-CCS). The summer school will familiarize the best students in computational […]

Picking flowers: Hands-on FLEUR

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This tutorial focuses on training the participants in using our all-electron FLAPW DFT code FLEUR (www.flapw.de) and associated codes like Spex-FLEUR, a code for many-body perturbation theory, and G-FLEUR, an embedding code. In extension to similar previous tutorials it also addresses the usage of FLEUR within the AiiDA infrastructure to build automatic work-flows applicable to […]

Webinar: Implementing I/O Best Practices to Improve System Performance with Ellexus

On September 9, 2019, Guest Lecturer Rosemary Francis will explain common I/O problems and best practices to implement easy performance wins in the 11th POP Guest Webinar - Implementing I/O Best Practices to Improve System Performance with Ellexus. She will outline I/O profiling for improving application performance as well as I/O monitoring for improving HPC […]

Summer School on Advanced Materials and Molecular Modelling with Quantum ESPRESSO

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The aim of the school is to introduce students, postdocs, and other researchers to materials and molecular modelling with Quantum ESPRESSO. The school will cover basic concepts as well as recent advances and developments, with emphasis on density-functional-theory based methods and high-performance computing. The school will follow a two-decade-long tradition of Quantum ESPRESSO training courses that have been […]

Webinar: The Successful Interaction of ChEESE and POP – a cross-collaboration of CoEs

ChEESE is a new initiative to integrate HPC and data across Solid Earth related disciplines in Europe. One of its main goals is to prepare ten flagship codes for exascale environments. These codes cover fields of study highly relevant for urgent computing, probabilistic hazard assessment and data science, such as computational seismology, magnetohydrodynamics, physical volcanology, […]