Archives

Talks by Dr Paul Bauer at University of Oxford

25 Feb, 2019 – 26 Feb, 2019 @ 00:00 – Dr Paul Bauer from the GROMACS Development team at KTH will visit University of Oxford on 25 – 26 February 2019 to present talks on the following topics. Trying to understand enzyme catalysis using QM/MM EVB: Example of epoxide hydrolysis Monday 25th 9:30am, Wolfson room, CRL On Monday, 25th Feb, he will give a talk on showcasing the Empirical Valence Bond (EVB) method […] [...]

BioExcel/MolSSI Workshop on Workflows in Biomolecular Simulations

11 Dec, 2018 – 14 Dec, 2018 @ 00:00 – As part of the collaborative framework, BioExcel CoE and MolSSI are organizing a series of workshops on the application of workflow solutions for biomolecular modelling and simulations. This first event will be by invitation only and will be hosted by BioExcel in Barcelona. A follow-up is planned for 2019 in the US hosted by MolSSI. […] [...]

Minisymposium: Biomolecular simulation in drug discovery

29 Nov, 2018 @ 09:00 – 17:00 – SciLifeLab will be organising a workshop on: Biomolecular simulation in drug discovery in Stockholm. The programme will include talks on molecular modelling applications, drug discovery as well as talks on selected abstracts. More information can be found here. Registration open here : https://www.scilifelab.se/events/minisymposium-biomolecular-simulation-in-drug-discovery/ [...]

Workshop on “Sharing Data from Molecular Simulations”

25 Nov, 2018 – 27 Nov, 2018 @ All Day – (Update: Recordings of the workshop presentations are available here and on our Youtube channel. And here are the slides from the talks.) BioExcel is organizing a workshop on “Sharing Data from Molecular Simulations”. This event will be located at the Rönnerberga Konferens center on Lidingö island (Sweden) from the 25th to the 27th of November. […] [...]

BioExcel Community Workshop 2018

21 Nov, 2018 – 22 Nov, 2018 @ All Day – On Wednesday 21st November we will be running a workshop event in the Netherlands focused on GROMACS and HADDOCK development. This event is by invitation only, but if you are interested in attending, please contact your Interest Group leader or Adam Carter <adamc@bioexcel.eu> and we can put you in touch with the workshop organisers. Looking […] [...]