Wiki source code of Molecular Tools: computation of unbinding rates
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| 5 | = Molecular Tools: computation of unbinding rates = | ||
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| 7 | Authors: D. Kokh | ||
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| 15 | = What can I find here? = | ||
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| 17 | * Jupyter Lab workflows that helps to setup, carry out, and analyze dissociation of protein-drug and protein-protein complexes | ||
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| 20 | [[image:workflow.png||alt="tauRAMD_workflow"]] | ||
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| 25 | = Who has access? = | ||
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| 27 | All EBRAINS users | ||
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| 30 | (% class="text-uppercase" %)Jupyter notebooks: | ||
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| 34 | **Computation of Protein-Protein Unbinding rates**: Jupyter Notebooks/PP-kinetics.ipynb | ||
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| 36 | [[https:~~/~~/lab.ebrains.eu/user/dariak/lab/tree/drive/Shared%20with%20all/Molecular%20Tools:%20computation%20of%20%20unbinding%20rates%20>>https://lab.ebrains.eu/user/dariak/lab/tree/drive/Shared%20with%20groups/Molecular%20Tools:%20computation%20of%20%20unbinding%20rates%20]] | ||
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| 39 | **Computation of Protein-Ligand Unbinding rates**: under development | ||
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| 49 | {{box title="**Contents**"}} | ||
| 50 | {{toc/}} | ||
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