Simon A Bray (Simon Bray)

Years Active: 2020-2022
Publications (10 Years): 6

Albert-Ludwigs-Universität Freiburg (MSC)

This page only lists publications with an associated author ORCID identifier.

Education History

Albert-Ludwigs-Universität Freiburg

Germany

MSC

University of York

United Kingdom

BSC

Publications

Simon A Bray, Tim Dudgeon, Rachael E Skyner, Rolf Backofen, Bjoern Andreas Gruening, Frank von Delft
Galaxy workflows for fragment-based virtual screening: a case study on the SARS-CoV-2 main protease. Journal of cheminformatics 14 (1) (2022)
Qiang Gu, Anup Kumar, Simon A Bray, Allison L Creason, Ali Reza Khanteymoori, Vahid Jalili, Bjoern Andreas Gruening, Jeremy Goecks
Galaxy-ML: An accessible, reproducible, and scalable machine learning toolkit for biomedicine. PLoS computational biology 17 (6) (2021)
Wolfgang Maier, Simon A Bray, Marius van den Beek, Dave Bouvier, Nathan Coraor, Milad Miladi, Babita Singh, Jordi Rambla De Argila, Dannon Baker, Nathan Roach, Simon Gladman, Frederik Coppens, Darren P Martin, Andrew Lonie, Björn Grüning, Sergei L Kosakovsky Pond, Anton Nekrutenko
Ready-to-use public infrastructure for global SARS-CoV-2 monitoring. Nature biotechnology 39 (10) (2021)
Simon A Bray, Xavier Lucas, Anup Kumar, Bjoern Andreas Gruening
The ChemicalToolbox: reproducible, user-friendly cheminformatics analysis on the Galaxy platform. Journal of cheminformatics 12 (1) (2020)
Steffen Wolf, Benjamin Lickert, Simon A Bray, Gerhard Stock
Multisecond ligand dissociation dynamics from atomistic simulations. Nature communications 11 (1) (2020)
Simon A Bray, Tharindu Senapathi, Christopher B Barnett, Bjoern Andreas Gruening
Intuitive, reproducible high-throughput molecular dynamics in Galaxy: a tutorial. Journal of cheminformatics 12 (1) (2020)

Simon A Bray.css-eqlu8i{font-size:small;padding-left:4px;} (Simon Bray)