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  1. An-automated-pipeline-for-homology-modeling An-automated-pipeline-for-homology-modeling Public

    An automated pipeline for homology-modeling based on modeller

    Python 6 2

  2. virtual-screening virtual-screening Public

    HTML 1 3

  3. models2dock models2dock Public

    This is an automated pipeline to fix models that generated by Modeller and use scripts to prepare the ligands and receptors for Autodock Vina.

    Python 1 2

  4. dock2interaction_profile dock2interaction_profile Public

    This is a simple script to use [plip](https://github.com/pharmai/plip) to batch analysis of interactions between proteins and ligands that are results of smina (vina) docking.

    Shell 7 2

  5. kegg-Crawler kegg-Crawler Public

    kegg相关的爬虫以及结果

    Python

  6. MyChemscript_repo MyChemscript_repo Public

    My repository for some useful Cheminformatics scripts.

    Python 1