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Centre of Excellence for Computational Biomolecular Research

Centre of Excellence for Computational Biomolecular Research

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BioExcel Introductory Video

Short video presentation of the center

View video

Buidling a FAIR Bioinformatics Environment

Supporting the Pharmaceutical Industry: BioExcel experts visit UCB

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Interview with Professor Michael Levitt, 2013 Nobel Laureate in Chemistry

In 2013 the Nobel Prize in Chemistry was awarded jointly to three scientists who laid the foundations of computational biomolecular research – Martin Karplus, Michael Levitt and Arieh Warshel. The ...

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Webinar: COMPSs: a high level framework for the development of parallel applications (2018-11-07)

 BioExcel’s webinar series continue with a presentation by Dr. Daniele Lezzi, Barcelona Supercomputing Center. Register Abstract One of the biggest challenges in the programming ...

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Latest News

  • GROMACS 2018.4 is available

    GROMACS 2018.4 is available

    November 13, 2018
  • New 2018 European HPC Handbook released

    New 2018 European HPC Handbook released

    November 8, 2018
  • GROMACS 2018 workshop in Gottingen

    GROMACS 2018 workshop in Gottingen

    November 5, 2018
  • BioExcel: building a FAIR bioinformatics environment

    BioExcel: building a FAIR bioinformatics environment

    October 29, 2018
  • New HADDOCK2.4 server coming up

    New HADDOCK2.4 server coming up

    October 10, 2018

Webinars

  • Webinar: MDBenchmark: a tedious task – made straightforward (2018-11-23)

    Webinar: MDBenchmark: a tedious task – made straightforward (2018-11-23)

  • Webinar: COMPSs: a high level framework for the development of parallel applications (2018-11-07)

    Webinar: COMPSs: a high level framework for the development of parallel applications (2018-11-07)

  • Webinar: How to contribute to GROMACS code and documentation: where it is and how to use it (2018-10-30)

    Webinar: How to contribute to GROMACS code and documentation: where it is and how to use it (2018-10-30)

  • Webinar: Open Force Field Initiative: The SMIRNOFF format and learned chemical perception (2018-10-10)

    Webinar: Open Force Field Initiative: The SMIRNOFF format and learned chemical perception (2018-10-10)

Featured

  • GROMACS 2018 workshop in Gottingen

    GROMACS 2018 workshop in Gottingen

    November 5, 2018
  • Supporting the Pharmaceutical Industry: BioExcel experts visit UCB’s R&D site in Belgium

    Supporting the Pharmaceutical Industry: BioExcel experts visit UCB’s R&D site in Belgium

    October 8, 2018

Events

  • Workshop on “Sharing Data from Molecular Simulations”

    Workshop on “Sharing Data from Molecular Simulations”

  • BioExcel/MolSSI Workshop on Workflows in Biomolecular Simulations

    BioExcel/MolSSI Workshop on Workflows in Biomolecular Simulations

  • GROMACS 2018 developer / power-user workshop

    GROMACS 2018 developer / power-user workshop

  • BioExcel 2nd SIG Meeting: “Advanced Simulations for Biomolecular Research” @ ECCB 2018

    BioExcel 2nd SIG Meeting: “Advanced Simulations for Biomolecular Research” @ ECCB 2018

  • BioExcel-MolSSI Symposium at PASC 2018

    BioExcel-MolSSI Symposium at PASC 2018

Publications

  • New 2018 European HPC Handbook released

    New 2018 European HPC Handbook released

    November 8, 2018
  • M3: an integrative framework for structure determination of molecular machines

    M3: an integrative framework for structure determination of molecular machines

    July 12, 2018
  • Performance of HADDOCK and a simple contact-based protein-ligand binding affinity predictor in the D3R Grand Challenge 2

    Performance of HADDOCK and a simple contact-based protein-ligand binding affinity predictor in the D3R Grand Challenge 2

    June 27, 2018
  • BioExcel Whitepaper on Scientific Software Development

    BioExcel Whitepaper on Scientific Software Development

    May 21, 2018

Job Opportunities

  • Job: PhD position in BioSciences – University of Bath

  • Job: Senior Scientist – CADD at UCB Pharma

  • Job: Scientific Programmer at KTH, Stockholm

  • Scientific Project Officer, EMBL-EBI

  • PhD position in “Modeling and Simulation of Chemical Senses”, FZ Juelich

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Contact and Support

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Funding

BioExcel is funded by the European Union
Horizon 2020 program under grant agreement 675728

· © 2018 BioExcel ·

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