MolBioMedUAB's repositories
AMBER_parameters
Repository for placing parameters and charges files (frcmod and mol2) of substrates used in our lab. All available files are distributed into folders depending on if they correspond to an enzyme, substrate or the combination of both from a docking simulation.
common_errors_in_calculations
Repo to store common errors that can be found when performing calculations. Its aim is to store both errors and their solution if any.
MIT000
Language:Shell000
Language:Jupyter Notebook000
scripts
Collection of useful scripts for the kind of calculations performed in the group
Language:Python000