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  1. RAMAplot RAMAplot Public

    Generate Ramachandran plots for single PDB structure and as heatmap for MD trajectory

    Python 11

  2. Kinformation_MD Kinformation_MD Public

    Classification of Protein Kinase Conformations in MD trajectory

    Python 1

  3. Structure-Based_docking Structure-Based_docking Public

    Scripts to do docking, single virtual screening, and etc.

    Python 21 5

  4. Ligand_Enrichment Ligand_Enrichment Public

    Calculate the AUC performance of Virtual Screening Enrichment

    Python 5 2

  5. Useful_Scripts Useful_Scripts Public

    General Linux/Python scripts for various purposes

    Python 1