MDAnalysis Online Workshop

MDAnalysis

Join us for a FREE virtual workshop to introduce the MDAnalysis Python package and demonstrate use cases through interactive tutorials

The application slots for this workshop are now full, or the application period has ended. Be sure to check out our other upcoming workshops.

MDAnalysis is a free, open source Python library for manipulating and analysing data from molecular simulations, with a focus on molecular dynamics. Written by scientists for scientists, it is used for cutting edge research around the world and supports file formats from most programs (GROMACS, Amber, LAMMPS, etc.). MDAnalysis allows you to write powerful and transferable analysis scripts. Who and W﻿hat?This online workshop is free and suitable for researchers in the broad area of computational (bio)chemistry, materials science and chemical engineering. It is designed for those who are beginners to MDAnalysis, but already have previous knowledge of Python and working with shell and notebook environments. The program will consist of an introduction to MDAnalysis, followed by basic MDAnalysis tutorials. While we will not be demonstrating how to install MDAnalysis during the workshop, we will provide instructions/resources and are able to assist beforehand to help you set up an environment on your local machine. Where and When?T﻿his workshop will be held online on Wednesday, October 25, 2023 from 15:00-18:30 UTC. We are looking into organizing the next workshop for Australasian time zones, so also keep an eye out for announcements of future workshops.ApplicationsA﻿pplication deadline: Saturday, September 30, 2023The workshop will be delivered to a small group to allow interactive discussions, questions, and participant engagement. Through this short application form, we would like to understand how you expect your participation in this workshop will help with your research and professional development. Applications will be reviewed after the September 30 deadline, and selected participants will be notified in early October.We have a small number of bursaries available to enable participation for underrepresented and early career researchers who are facing financial barriers. These can be applied for when completing your application form via this site.Please contact <a href="https://groups.google.com/a/mdanalysis.org/g/workshops" target="_blank" data-msys-clicktrack="0" rel="nofollow noopener noreferrer">workshops@mdanalysis.org</a> with any questions.

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