BioExcel CoE series of educational webinars for computational biomolecular research. The series cover broad topics related to the latest development of the supported software packages; their application to modelling and simulation; best practices for performance tuning and efficient usage on HPC and novel architectures; introductory tutorials for entry level users and much more.

Webinar: Hybrid Molecular Mechanics/Coarse-Grained approaches to model proteins with unknown 3D structure and low sequence identity: the case of G protein-coupled receptors (2017-12-14)

Discuss this webinar View slides on SlideShare Join Interest Group BioExcel’s webinar series continue with a special discussion on multiple timescales in atomistic simulations and ways to address specific challenges in such models. Register Abstract Multiscale molecular dynamics approaches couple, in the same simulation, descriptions of the system at different […]

Webinar: “MDStudio, microservice based molecular dynamics workflows” (2017-10-11)

Discuss this webinar View slides on SlideShare  Join Interest Group BioExcel’s webinar series continue with an introduction of the workflow tool, MDStudio. The webinar is part of the collaborative work plan between BioExcel and Vrije Universiteit Amsterdam. Abstract Molecular Dynamics (MD) is becoming an essential method in the research toolkit of academic and […]

Webinar: NAFlex, a web server for the study of nucleic acid flexibility (2017-07-20)

Federica Battistini Molecular Modeling and Bioinformatics, Institute for Research in Biomedicine (IRB Barcelona), Barcelona, Spain.  federica.battistini@irbbarcelona.org BioExcel’s webinar series continues with another webinar focused on entry level users. In this case, Federica Battistini is going to talk about nucleic acid flexibility and how it could be extracted and visualized using NAFlex […]

Webinar: “BioExcel and OpenPHACTS: Building pharmacological workflow blocks for virtual screening” (2017-07-17)

Discuss this webinar View slides View webinar Workflows Interest Group BioExcel’s webinar series continues with Nick Lynch, who will introduce Open PHACTS, an integrated pharmacological data platform and BioExcel strategic partner. Nick is joined by Stian Soiland-Reyes and Adam Hospital who will explain in details how BioExcel is building a Virtual Screening workflow […]

Webinar: “Introduction to the Common Workflow Language (CWL) project” (2017-06-21)

Discuss this webinar View slides View webinar Workflows Interest Group BioExcel’s webinar series continues with Michael Crusoe, CWL Project co-founder & Community Engineer, who will introduce the Common Workflow Language (CWL) project. In July 2016 the CWL team released standards that enable the portable, interoperable, and executable description of command line data analysis tools and […]