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BioExcel-2

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BioExcel Centre of Excellence for ComputationalBiomolecular Research

Life Sciences have become increasingly digital and this is accelerating. Computational techniques play key roles in processing, analysis and generating new knowledge from experiments, even in replacing them. This has been enabled... ver más

30/06/2022

KTH

8M€

Presupuesto del proyecto: 8M€

Líder del proyecto

KUNGLIGA TEKNISKA HOEGSKOLAN No se ha especificado una descripción o un objeto social para esta compañía.

TRL 4-5

Fecha límite participación Sin fecha límite de participación.

Ver 14 Participantes

Financiación concedida El organismo H2020 notifico la concesión del proyecto el día 2022-06-30

INFRAEDI-02-2018: HPC PPP - Centres of Excellence on... Specific Challenge:This topic covers two interrelated and synergic areas:

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14 Participantes

KTH

1.99M€ | Lider

1.05M€ | Participante

MPG

483.75K€ | Participante

UEDIN

777.30K€ | Participante

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Duración del proyecto: 43 meses Fecha Inicio: 2018-11-12
Fecha Fin: 2022-06-30

Líder del proyecto

KUNGLIGA TEKNISKA HOEGSKOLAN No se ha especificado una descripción o un objeto social para esta compañía.

TRL 4-5

Presupuesto del proyecto 8M€

Fecha límite de participación Sin fecha límite de participación.

Descripción del proyecto Life Sciences have become increasingly digital and this is accelerating. Computational techniques play key roles in processing, analysis and generating new knowledge from experiments, even in replacing them. This has been enabled due to tremendous advances in techniques such as docking and molecular simulations at both atomistic and quantum levels to which world-leading European research and software are contributing. Pushing computational capabilities towards Exascale will advance the area, enabling researchers to tackle increasingly complex questions related to biomolecules' function, mechanisms, dynamics and interactions. This will impact on our daily life, in health, for the development of new drugs and efficient drug delivery methods, in biotechnology, environment, agriculture, food industry and education. To exploit this great computational power, in academia and industry, significant efforts on software efficiency, scaling, usability and education are needed. This is the mission of the BioExcel Centre of Excellence for Computational Biomolecular Research launched in 2015 with EC support. It has made significant contributions by focusing on highest-impact European codes, workflows and an extensive, international education program. BioExcel-2 will continue and expand this work, with a focus on Exascale impact, improved usability, expanded training and commercial applications, while strengthening its user-driven governance. Specifically it will: * Push performance, efficiency, scalability and usability of the selected software packages towards Exascale in a co-design manner, contributing to the EuroHPC vision * Support convergence of HPC, HTC, and HPDA with workflows combining simulations with data management and analytics * Support and enlarge the user community by providing support, workforce development, continued training, guidance, and best practices * Develop a sustainable and open community centre with user-driven governance and clear KPIs.

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