BioExcel building blocks workflows used in the COVID-19 research to
- Model and compute MD simulations for different mutations across species
- Compute alchemical free energy differences upon mutations
This software has been developed in the MMB group at the BSC & IRB for the European BioExcel, funded by the European Commission (EU H2020 823830, EU H2020 675728).
- (c) 2015-2020 Barcelona Supercomputing Center
- (c) 2015-2020 Institute for Research in Biomedicine
Licensed under the Apache License 2.0, see the file LICENSE for details.
