A repository for molecular dynamics simulations, generated by you.

MD Repo is an open repository of MD simulations for proteins, with or without ligands, generated by researchers like you. Explore simulations using the search box below to filter by protein name/id, ligand, or contributor. To contribute or batch-download simulations, please sign in with your ORCID iD .

Note: MD Repo is in a beta testing stage. Its functionality works for us and a few testers, but surely some feature will not work as expected "in the wild". Please contact us to report errors or feature requests: help@mdrepo.org