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Simon Bray

Contributions

The following list includes only slides and tutorials where the individual has been added to the contributor list. This may not include the sum total of their contributions to the training materials (e.g. GTN css or design, tutorial datasets, workflow development, etc.) unless described by a news post.

GitHub Activity

• github Pull Requests
• github Commits
• github Issues Reported

Tutorials

• Computational chemistry / Protein target prediction of a bioactive ligand with Align-it and ePharmaLib
• Computational chemistry / Running molecular dynamics simulations using GROMACS
• Computational chemistry / Running molecular dynamics simulations using NAMD
• Computational chemistry / Analysis of molecular dynamics simulations
• Computational chemistry / Setting up molecular systems
• Computational chemistry / Virtual screening of the SARS-CoV-2 main protease with rxDock and pose scoring
• Computational chemistry / Protein-ligand docking
• Computational chemistry / High Throughput Molecular Dynamics and Analysis
• Statistics and machine learning / Regression in Machine Learning
• Statistics and machine learning / Classification in Machine Learning
• Development in Galaxy / Contributing to BioBlend as a developer
• Using Galaxy and Managing your Data / Automating Galaxy workflows using the command line

News