/tools/labodock

labodock

RyanZR/labodock

50 stars14 forksJupyter NotebookAdded February 4, 2026
summary

LABODOCK is a collection of Jupyter Notebooks designed for molecular docking using Google Colab. It simplifies the docking process by automating pre- and post-docking tasks and integrates various cheminformatics tools for effective in-silico experimentation.

description

LABODOCK: A Colab-Based Molecular Docking Tools

topics

autodock-vinacheminformaticsdrug-designgoogle-colabmolecular-dockingplipvirtual-screening

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