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Training on HPDA for climate data with the Ophidia framework

Online

This online training course aims to provide a basic understanding of HPDA challenges for eScience and how these are addressed by the Ophidia HPDA framework. Ophidia is a CMCC Foundation research effort targeting scientific data-intensive analysis, by joining HPC paradigms and Big Data approaches. The framework specifically targets the analysis on top of HPC systems and is currently involved in the ESiWACE2 CoE and the eFlows4HPC EuroHPC JU projects for large-scale scientific data analytics.

Free

OpenMP Offloading Workshop

Online

ENCCS is offering a training workshop on November 18-19 focused on GPU offloading using OpenMP. These new features, which are available since version 4.0, make OpenMP a good option for researchers and developers who wish to accelerate their code on GPUs using a cross-platform framework supported by all HPC device vendors (including NVIDIA, AMD, and Intel)

Free

Advanced Deep Learning with Transformers – ENCCS/RISE

Online

This workshop will take you from the representation of graphs and finite sets as inputs for neural networks to the implementation of full GNNs for a variety of tasks. You will learn about the central concepts used in GNNs in a hands-on setting using Jupyter Notebooks and a series of coding exercises. While the workshop will use problems from the field of chemistry as an example for applications, the skills you learn can be transferred to any domain where finite set or graph-based representations of data are appropriate. From GNNs, we will make the leap to Transformer architectures, and explain the conceptual ties between the two.

Free

CMake Workshop

Online

CMake is a language-agnostic, cross-platform build tool and is nowadays the de facto standard, with large projects using it to reliably build, test, and deploy their codebases.

Free

ENCCS/NVIDIA GPU Hackathon

Online

GPU hackathons offer a unique opportunity for domain scientists and research software engineers to accelerate and optimize their applications on GPUs. Teams of researchers are paired with experienced GPU mentors to learn and apply the accelerated and parallel computing skills needed by the scientific community. Both current or prospective users of large hybrid CPU/GPU HPC clusters who develop applications that could benefit from GPU acceleration are encouraged to participate!

Free

ONLINE PATC: OpenFOAM training workshop

Online

This workshop will cover all foundational aspects of OpenFOAM, including an introduction to OpenFOAM enviroment as well as running on HPC resources.  It will be useful for new users to broaden their basic knowledge of OpenFOAM.

Free

A.I. as a Tool for Change

Online

ENCCS with RISE offer a half-day course in A.I. as a tool for change. Participants will get an understanding of what artificial intelligence is, which problems can be solved with those techniques, and how they can be used within an organization.
We will give an overview on what processes one goes through when they utilize A.I. to solve problems. We are also going to illuminate the limitations of those techniques and give examples of when they are appropriate.

Free

Upscaling A.I. with Containers

Online

This workshop will take you from the representation of graphs and finite sets as inputs for neural networks to the implementation of full GNNs for a variety of tasks. You will learn about the central concepts used in GNNs in a hands-on setting using Jupyter Notebooks and a series of coding exercises. While the workshop will use problems from the field of chemistry as an example for applications, the skills you learn can be transferred to any domain where finite set or graph-based representations of data are appropriate. From GNNs, we will make the leap to Transformer architectures, and explain the conceptual ties between the two.

Free

GROMACS Workshop – ENCCS/CSC/BioExcel

Online

This course gives advanced practical tips on how to run GROMACS MD simulations efficiently on modern hardware including both CPUs and GPUs. In addition to speeding up MD simulations, also workflow automation, advanced sampling techniques, and future developments are discussed. The course consists of lectures and hands-on exercises. GROMACS will be used in the exercise sessions.

Free

Julia for High-Performance Scientific Computing

Online

Julia is a modern high-level programming language which is both fast (on par with traditional HPC languages like Fortran and C) and relatively easy to write like Python or Matlab. It thus solves the “two language problem”, i.e. when prototype code in a high-level language needs to be combined with or rewritten in a lower-level language to improve performance. Although Julia is a general purpose language, many of its features are particularly useful for numerical scientific computation, and a wide range of both domain-specific and general libraries are available for statistics, machine learning and numerical modeling. The language supports parallelisation for both shared-memory and distributed HPC architectures, and native Julia libraries are available for running on GPUs from different vendors.

Free

Introduction to Deep-Learning

Online

The use of Deep Learning has seen a sharp increase of popularity and applicability over the last decade. While Deep Learning can be a useful tool for researchers from a wide range of domains, taking the first steps in the world of Deep Learning can be somewhat intimidating. This introduction aims to cover the basics of Deep Learning in a practical and hands-on manner, so that upon completion, you will be able to train your first neural network and understand what next steps to take to improve the model.

Free

VeloxChem: Quantum Chemistry Towards Pre-exascale and Beyond – ENCCS/PDC

Online

Quantum molecular modeling of complex molecular systems is an indispensable and integrated component in advanced material design, as such simulations provide a microscopic insight into the underlying physical processes. ENCCS and PDC will offer training on using the VeloxChem program package. We will highlight its efficient use on modern HPC architectures, such as the Dardel system at PDC and the pre-exascale supercomputer LUMI, 50% of which is available to academic users of the consortium states, including Sweden and Denmark.

Free

Advanced Deep Learning with Transformers – ENCCS/RISE

Online

In recent years, Graph Neural Networks (GNNs) and Transformers have led to numerous breakthrough achievements in a variety of fields such as Natural Language Processing (NLP), chemistry, and physics. By doing away with the need for fixed-size inputs, these architectures significantly extend the scope of problems in which deep learning can be applied.

Free

SYCL Workshop

Online

SYCL is a C++ abstraction layer for programming heterogeneous hardware with a single-source approach. SYCL is high-level, cross-platform, and extends standard ISO C++17. You will learn to:

Free

Upscaling A.I. Workflows

Online

In this workshop, we overview the basics of Docker and Singularity. (Working knowledge of Singularity as given in the workshop (https://www.uppmax.uu.se/support/courses-and-workshops/singularity-workshop-announcement) is desirable.) Distributed training using TensorFlow and Horovod frameworks on a supercomputer will be covered. Moreover, it will be shown how to use Singularity containers in conjunction with TensorFlow and Horovod to upscale an AI app.

High Performance Data Analytics in Python

Online

This online workshop is meant to give an overview of working with research data in Python using general libraries for storing, processing, analysing and sharing data. The focus is on improving performance. After covering tools for performant processing (netcdf, numpy, pandas, scipy) on single workstations the focus shifts to parallel, distributed and GPU computing (snakemake, numba, dask, multiprocessing, mpi4py).

Introduction to Quantum Computing & Hybrid HPC-QC Systems

Online

ENCCS is now joining forces with NordiQuEst to deliver a two-day training workshop covering the fundamentals of quantum computing (QC), including introduction to key concepts: quantum states, qubits, quantum algorithms, QC programming in high-level languages for use cases in optimisation, finance and quantum chemistry followed by testing quantum programs to esure their correctness, overview of the main QC hardware approaches
Integration of QC with classical computing: hybrid classical/quantum algorithms and HPC-QC systems.

The 10th OpenMolcas Developers’ Workshop [Hybrid]

Uppsala university Ångström laboratory, room 80127 (house 8, floor 0), Upssala, Sweden

We are pleased to announce the 10th edition of the OpenMolcas developers' workshop, bringing together the community of developers, users, and anyone else interested in the project. This year the workshop is hosted by the Quantum Chemistry Group at Uppsala University and we are very excited to announce that ENCCS teams up with TREX for the organization, but most importantly will contribute to the scientific part as well!

Intermediate Topics in MPI

Online

This workshop targets programmers in both academia and industry who already have experience with basic MPI and are ready to take the next step to more advanced usage. Topics which will be covered include communicators, groups, derived data types, one-sided communication, non-blocking collectives and hybrid MPI+threading approaches. Lectures will be interleaved with hands-on exercises. All […]

Free