BioExcel supported the first workshop on “Sharing Data from Molecular Simulations – SDMS18”, which took place in Stockholm between 25-27th Nov. 2018. Here you can find recordings of the talks and discussions during the workshop. A follow-up event, organized by MolSSI, is planned for 2019 in USA. Below you will […]
One month after the BioExcel/PDBe Hackathon, Diego, Panos and Brian share their insights about the event. Nowadays, structural biologist is synonym of user of the Protein Data Bank (PDB). However, using the PDB has conceptually changed in the last years. Rather than just downloading single PDB-formatted files at a time, the current […]
The 2018 GROMACS workshop was held in Gottingen aimed at people willing to develop new tools for GROMACS, as well as at experienced users wanting to gain more in depth knowledge about the inner workings of the program. Christian Blau, member of the GROMACS development team writes about his experience at […]
BioExcel was present in the last bioinformatics event from the Network Tools and Applications in Biology (Nettab) workshop series: Building a FAIR Bioinformatics environment (22nd to 24th October). The event was held in the beautiful city of Genoa, the capital of the Italian region of Liguria. Known as “the city […]
BioExcel continues its direct support to industry through site visits. In late May we were pleased to visit UCB’s research site in Braine D’Alleud, Belgium for an exciting day of in depth discussions. The morning started with our host, Dr Zara Sands of the Computer Aided drug Design group, giving […]
In a recent article we reported the performance of HADDOCK in the 2018 iteration of the Grand Challenge organised by the D3R consortium. Building on the findings of our participation in last year’s challenge, we significantly improved our pose prediction protocol which resulted in a mean RMSD for the top […]