Editor's picks

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Despite the buzz around artificial intelligence (AI), most industry insiders know that the use of machine learning (ML) in drug discovery is nothing new. For more than a decade, researchers have used computational techniques for many purposes, such as finding hits, modelling drug-protein interactions, and predicting reaction rates.

Credit: ECP

The Exascale Computing Projects, Doug Kothe, discusses the lasting impact of exascale development

DiRAC has created a structured training programme with a user feedback loop to drive training and skills development across its entire user-base

News

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01 February 2023

The European High Performance Computing Joint Undertaking (EuroHPC JU) launched two new calls for proposals to train future HPC specialists, develop a EuroHPC JU training platform and support the International HPC Summer School.

News

Credit: Thor Balkhed/Linköping University

25 January 2023

The Berzelius supercomputer at Linköping University is gearing up for a major upgrade to advance machine learning, healthcare and computer vision research

Credit: Aston University

20 January 2023

A researcher from the university of Aston has created the first ever computer reconstruction of a virus, including its complete native genome

Credit: Ohio Supercomputer Center

19 January 2023

OSC launched Ascend to provide GPU resources to process research and simulations that rely on AI, big data and machine learning

Analysis & opinion

Analysis & opinion

Credit: ECP

02 December 2022

The Exascale Computing Projects, Doug Kothe, discusses the lasting impact of exascale development

30 November 2022

DiRAC has created a structured training programme with a user feedback loop to drive training and skills development across its entire user-base

Credit: Gorodenkoff/Shutterstock

17 November 2022

Sachin Bhandari provides an overview of his talk at the upcoming Paperless Academy India

Features

Features

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18 September 2022

The difference between serial and parallel programming is enormous and increases when the objective is to take it to a high-performance ecosystem. The training process cannot focus only on learning specific technologies: scaling for HPC supposes a change in the way of analysing, planning and building software. 

Credit: Dassault Systèmes

07 September 2022

Aerospace is transforming to meet the current innovation and sustainability mandates, and today’s simulation tools are helping engineers design the aircraft of tomorrow. But in an industry entrenched in regulation and with notoriously long lead times, digital change has not always been easy to realise.

'Historically, simulation tools have lagged behind the market requirement, often playing catch up to address new trends and technologies,' according to Paul Lethbridge, director of product marketing at SimScale. 

Credit: Gorodenkoff/Shutterstock

15 August 2022

Scientists and researchers are using AI to help accelerate the discovery of new drugs for a wide variety of different medical applications.

Resources

Some 50-80% of research scientists' and data scientists' time is spent wrestling with data before they can focus on higher value AI/ML and advanced analysis to help bring new life-saving therapeutics to market.

Credit: Gorodenkoff/Shutterstock

From new instruments and software to the rise of the digital lab, the landscape of analytical chemistry data continues to evolve, writes Sanji Bhal, Director, Marketing & Communications

Credit: Gorodenkoff/Shutterstock

Despite the buzz around artificial intelligence (AI), most industry insiders know that the use of machine learning (ML) in drug discovery is nothing new. For more than a decade, researchers have used computational techniques for many purposes, such as finding hits, modelling drug-protein interactions, and predicting reaction rates.

Press releases

01 February 2023

Spectra’s Vail multi-cloud data management software enables customers to take full advantage of Wasabi’s cloud storage on demand

28 January 2023

Despite the promise of recent models such as ChatGPT, ineffective tools for improving data and label quality have halted the widespread adoption of AI models

28 January 2023

The US National Science Foundation has announced a cross-sector partnership to support the design of the next generation of semiconductors as part of its Future of Semiconductors (FuSe) initiative

Tech Focus

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Laboratory informatics tools have continued to converge around requirements for data management and movement within an organisation.

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A round-up of the latest technologies available to scientists and researchers using HPC

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A round-up of the latest processing and memory technologies