Molecular Tools: computation of unbinding rates
Authors: D. Kokh
What can I find here?
- Jupyter Lab workflows that helps to setup, carry out, and analyze dissociation of protein-drug and protein-protein complexes
Who has access?
All EBRAINS users
Jupyter notebooks:
Computation of Protein-Protein Unbinding rates: Jupyter Notebooks/PP-kinetics.ipynb
Computation of Protein-Ligand Unbinding rates: under development